5-bromo-4-methyl-1,2,3,4-tetrahydroisoquinolin-1-one
Structure Info
- Chemspace ID
- CSSB00020726584 (In-Stock Building Blocks)
- CAS
- 1782599-15-8, 2122452-59-7
- MFCD
- MFCD32268516, MFCD32268516
- IUPAC Name
- 5-bromo-4-methyl-1,2,3,4-tetrahydroisoquinolin-1-one
- Mol formula
- C10H10BrNO
- Mol weight
- 240 Da
- Catalog Number(s)
- AR028UN6, ArZ-UP195276, BB4LS-EN300-7506895, BBLS00020726584, BBV-95925233, BD02771368, BL71094, CSC020726584, EN300-7506895, FCH7059192, ST028VEY, TX028V3U, Y3243663, Z2733389598, ZX-NM238551, ZXC263541, bbls00020726584
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.22
- Heavy atoms count
- 13
- Rotatable bond count
- 0
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.3
- Polar surface area (Å)
- 29
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSB00020726584
Items Overall 23 items from 5 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| BB4LS US | 2 days | United States To: | 95 | 50 umol | 289.23 | |
| BB4LS US | 2 days | United States To: | 95 | 100 umol | 399.53 | |
| BB4LS US | 2 days | United States To: | 95 | 200 umol | 538.66 | |
| BB4LS US | 2 days | United States To: | 95 | 300 umol | 638.00 | |
| BB4LS US | 2 days | United States To: | 95 | 500 umol | 765.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 545.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 712.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 1,015.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 1,599.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 2,050.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 545.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 712.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 1,015.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 1,599.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 50 umol | 289.23 | |
| BB4LS EU | 7 days | Germany To: | 95 | 100 umol | 399.53 | |
| BB4LS EU | 7 days | Germany To: | 95 | 200 umol | 538.66 | |
| BB4LS EU | 7 days | Germany To: | 95 | 300 umol | 638.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 500 umol | 765.00 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 50 mg | 684.20 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 100 mg | 877.80 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 250 mg | 1,228.70 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 500 mg | 1,905.20 | |
Description: 5-bromo-4-methyl-1,2,3,4-tetrahydroisoquinolin-1-one; CAS: 1782599-15-8 | ||||||
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Substructure Analogs
![Chemical structure of 5'-bromo-7'-(hydroxymethyl)-2',3'-dihydro-1'H-spiro[cyclopropane-1,4'-isoquinolin]-1'-one - CSSB21349744337](/st/structure/200/62dce883d42fe7e7812f8bbe719813e0/OCC1%253DCC%2528Br%2529%253DC2C%2528%253DC1%2529C%2528%253DO%2529NCC21CC1.png)
![Chemical structure of 5'-bromo-7'-(chloromethyl)-2',3'-dihydro-1'H-spiro[cyclopropane-1,4'-isoquinolin]-1'-one - CSSB20621662642](/st/structure/200/1974626d3e03e6332a7430e343c1d7c7/ClCC1%253DCC%2528Br%2529%253DC2C%2528%253DC1%2529C%2528%253DO%2529NCC21CC1.png)
![Chemical structure of methyl 5'-bromo-1'-oxo-2',3'-dihydro-1'H-spiro[cyclopropane-1,4'-isoquinoline]-7'-carboxylate - CSSB21349744338](/st/structure/200/2e37abbd373f7b627997f4d43f69ecf9/COC%2528%253DO%2529C1%253DCC%2528Br%2529%253DC2C%2528%253DC1%2529C%2528%253DO%2529NCC21CC1.png)
![Chemical structure of 5'-bromo-7'-[(1E)-2-methoxyethenyl]-2',3'-dihydro-1'H-spiro[cyclobutane-1,4'-isoquinolin]-1'-one - CSSB21415998194](/st/structure/200/eedfe8ae2b39f52e17d3c9717cbdb3da/CO%255CC%253DC%255CC1%253DCC%2528Br%2529%253DC2C%2528%253DC1%2529C%2528%253DO%2529NCC21CCC1.png)
![Chemical structure of methyl 5'-bromo-1'-oxo-2',3'-dihydro-1'H-spiro[cyclobutane-1,4'-isoquinoline]-7'-carboxylate - CSSB20621662947](/st/structure/200/7cf3428652fc0ca68ed8a51b321e31cf/COC%2528%253DO%2529C1%253DCC%2528Br%2529%253DC2C%2528%253DC1%2529C%2528%253DO%2529NCC21CCC1.png)
![Chemical structure of 5'-bromo-7'-{[(tert-butyldimethylsilyl)oxy]methyl}-2',3'-dihydro-1'H-spiro[cyclopropane-1,4'-isoquinolin]-1'-one - CSSB20621662646](/st/structure/200/3a747dc5b9f8fc156a48b2154dc7899a/CC%2528C%2529%2528C%2529%255BSi%255D%2528C%2529%2528C%2529OCC1%253DCC%2528Br%2529%253DC2C%2528%253DC1%2529C%2528%253DO%2529NCC21CC1.png)
![Chemical structure of 5'-bromo-7'-{[(tert-butyldimethylsilyl)oxy]methyl}-2',3'-dihydro-1'H-spiro[cyclobutane-1,4'-isoquinolin]-1'-one - CSSB21415998101](/st/structure/200/2d137899220b0a1a8cab8a7ca95becd4/CC%2528C%2529%2528C%2529%255BSi%255D%2528C%2529%2528C%2529OCC1%253DCC%2528Br%2529%253DC2C%2528%253DC1%2529C%2528%253DO%2529NCC21CCC1.png)
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![Chemical structure of 2-bromo-N-[2-(3,5-difluorophenyl)propyl]benzamide - CSSB01670957552](/st/structure/200/1041005a7bcf64cb73c6dd7a654cc8e2/CC%2528CNC%2528%253DO%2529C1%253DCC%253DCC%253DC1Br%2529C1%253DCC%2528F%2529%253DCC%2528F%2529%253DC1.png)
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