Ethyl 3-chloro-8-thia-4,6-diazatricyclo[7.4.0.0²,⁷]trideca-1(9),2,4,6-tetraene-5-carboxylate
Structure Info
- Chemspace ID
- CSSB00020636697 (In-Stock Building Blocks)
- CAS
- 40106-51-2
- MFCD
- MFCD03030435, MFCD01578278
- IUPAC Name
- ethyl 3-chloro-8-thia-4,6-diazatricyclo[7.4.0.0²,⁷]trideca-1(9),2,4,6-tetraene-5-carboxylate
- Mol formula
- C13H13ClN2O2S
- Mol weight
- 297 Da
- Catalog Number(s)
- AG01EDM8, AG134540, AR01EEB8, BBLS00020636697, BD268864, CD11129173, CSC020636697, EN300-18626667, QBA10651, ST01EF30, Y3622299, Z3241272193, bbls00020636697
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.36
- Heavy atoms count
- 19
- Rotatable bond count
- 3
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.461
- Polar surface area (Å)
- 52
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
![Chemical structure of Ethyl 3-chloro-8-thia-4,6-diazatricyclo[7.4.0.0²,⁷]trideca-1(9),2,4,6-tetraene-5-carboxylate (C13H13ClN2O2S) - CSSB00020636697](/st/structure/200/72379d0ebc940cca0997e94dc44f5a73/CCOC%2528%253DO%2529C1%253DNC%2528Cl%2529%253DC2C%2528SC3%253DC2CCCC3%2529%253DN1.png "C13H13ClN2O2S")
- Zoom the structure
- CSSB00020636697
Items Overall 37 items from 6 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| BB4LS US | 2 days | United States To: | 95 | 50 umol | 94.93 | |
| BB4LS US | 2 days | United States To: | 95 | 100 umol | 132.13 | |
| BB4LS US | 2 days | United States To: | 95 | 200 umol | 182.00 | |
| BB4LS US | 2 days | United States To: | 95 | 300 umol | 231.00 | |
| BB4LS US | 2 days | United States To: | 95 | 500 umol | 285.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 162.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 241.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 347.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 546.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 699.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 2.5 g | 1,370.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 5 g | 2,028.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 10 g | 3,007.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 50 mg | 162.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 100 mg | 241.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 250 mg | 347.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 500 mg | 546.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 1 g | 699.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 2.5 g | 1,370.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 162.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 241.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 347.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 546.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 1 g | 699.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 2.5 g | 1,370.00 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 50 umol | 94.93 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 100 umol | 132.13 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 200 umol | 182.00 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 300 umol | 231.00 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 500 umol | 285.00 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 50 mg | 240.90 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 100 mg | 332.20 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 250 mg | 455.40 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 500 mg | 685.30 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 1 g | 862.40 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 2.5 g | 1,640.10 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 5 g | 2,401.30 | |
Description: Ethyl 4-chloro-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidine-2-carboxylate; CAS: 40106-51-2 | ||||||
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