(2E)-3-[(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]prop-2-enoic acid
Structure Info
- Chemspace ID
- CSSB00132387299 (In-Stock Building Blocks)
- MFCD
- MFCD02236954
- IUPAC Name
- (2E)-3-[(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]prop-2-enoic acid
- Mol formula
- C17H20N2O3S
- Mol weight
- 332 Da
- Catalog Number(s)
- AA02XPRL, AN-919/15183009, BX32173, CSC132387299, OSSL_001682, ST02XRB5, STK283303, STOCK2S-06762, TX02XR01, UZI/9070904
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.1
- Heavy atoms count
- 23
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.47
- Polar surface area (Å)
- 90
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 2
![Chemical structure of (2E)-3-[(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]prop-2-enoic acid (C17H20N2O3S) - CSSB00132387299](/st/structure/200/732450bb053215c3c0545a3bade31585/CC%2528C%2529%2528C%2529C1CCC2%253DC%2528C1%2529SC%2528NC%2528%253DO%2529%255CC%253DC%255CC%2528O%2529%253DO%2529%253DC2C%2523N.png "C17H20N2O3S")
- Zoom the structure
- CSSB00132387299
Items Overall 1 item from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific LLC | 14 days | United States To: | 90 | 10 mg | 245.30 | |
Description: (E)-4-[(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobut-2-enoic acid; CAS: 1231937-75-9 | ||||||
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