2-(benzylsulfanyl)-1-(1,2,5-trimethyl-1H-pyrrol-3-yl)ethan-1-one
Structure Info
- Chemspace ID
- CSSB00000586798 (In-Stock Building Blocks)
- MFCD
- MFCD12564585, MFCD12564585
- IUPAC Name
- 2-(benzylsulfanyl)-1-(1,2,5-trimethyl-1H-pyrrol-3-yl)ethan-1-one
- Mol formula
- C16H19NOS
- Mol weight
- 273 Da
- Catalog Number(s)
- BBLS00000586798, BBV-27097260, CSC000586798, CSC034333405, CSCR00034333405, EN300-16188183, SEL10204297, Z45292052, bbls00000586798, s_62_80828_81442, s_62____80828____81442
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.47
- Heavy atoms count
- 19
- Rotatable bond count
- 5
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.312
- Polar surface area (Å)
- 22
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSB00000586798
Items Overall 8 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 50 mg | 491.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 514.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 538.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 561.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 584.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 1,147.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 1,695.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 2,516.00 |
For a custom pack size or bulk
please drop us a line:Enquire
please drop us a line:Enquire
Substructure Analogs
![Chemical structure of 2-(benzylsulfanyl)-1-[2,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-3-yl]ethan-1-one - CSSB01038611225](/st/structure/200/67bc0684529d359bd8afe06fb957c7da/CC%2528C%2529N1C%2528C%2529%253DCC%2528C%2528%253DO%2529CSCC2%253DCC%253DCC%253DC2%2529%253DC1C.png)
![Chemical structure of 2-(benzylsulfanyl)-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one - CSSB00104398342](/st/structure/200/80f5bbd93dc12719cdd0767d4056e654/CC1%253DCC%2528C%2528%253DO%2529CSCC2%253DCC%253DCC%253DC2%2529%253DC%2528C%2529N1CC%253DC.png)
![Chemical structure of 2-(benzylsulfanyl)-1-[2,5-dimethyl-1-(prop-2-yn-1-yl)-1H-pyrrol-3-yl]ethan-1-one - CSSB15215530132](/st/structure/200/5bb4f823fd12304d7f8133de0ae9ca3c/CC1%253DCC%2528C%2528%253DO%2529CSCC2%253DCC%253DCC%253DC2%2529%253DC%2528C%2529N1CC%2523C.png)
![Chemical structure of 2-(benzylsulfanyl)-1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethan-1-one - CSSB02105190513](/st/structure/200/a21c8e76e048ea0f092ab9db6aaf88b3/COCCN1C%2528C%2529%253DCC%2528C%2528%253DO%2529CSCC2%253DCC%253DCC%253DC2%2529%253DC1C.png)
Similarity Analogs
![Chemical structure of 2-(benzylsulfanyl)-1-[2,5-dimethyl-1-(2-phenylethyl)-1H-pyrrol-3-yl]ethan-1-one - CSSB21332071051](/st/structure/200/5801ebeeb361995b591c9a107f20337b/CC1%253DCC%2528C%2528%253DO%2529CSCC2%253DCC%253DCC%253DC2%2529%253DC%2528C%2529N1CCC1%253DCC%253DCC%253DC1.png)
![Chemical structure of 2-(benzylsulfanyl)-1-[2,5-dimethyl-1-(2,2,2-trifluoroethyl)-1H-pyrrol-3-yl]ethan-1-one - CSSB00222232700](/st/structure/200/e44376dcf9f506d65dac236ed4ef1df4/CC1%253DCC%2528C%2528%253DO%2529CSCC2%253DCC%253DCC%253DC2%2529%253DC%2528C%2529N1CC%2528F%2529%2528F%2529F.png)
![Chemical structure of 2-(benzylsulfanyl)-1-[1-(diphenylmethyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethan-1-one - CSSB21332087995](/st/structure/200/5c4e0a199643c3b1779da5d5370be487/CC1%253DCC%2528C%2528%253DO%2529CSCC2%253DCC%253DCC%253DC2%2529%253DC%2528C%2529N1C%2528C1%253DCC%253DCC%253DC1%2529C1%253DCC%253DCC%253DC1.png)
