N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methoxybenzamide
Chemical Structure Depiction of
N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methoxybenzamide
N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methoxybenzamide
Compound characteristics
| Compound ID: | Y508-9511 |
| Compound Name: | N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methoxybenzamide |
| Molecular Weight: | 326.42 |
| Molecular Formula: | C18 H18 N2 O2 S |
| Smiles: | CC1CCc2c(C1)c(C#N)c(NC(c1ccc(cc1)OC)=O)s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1425 |
| logD: | 1.8396 |
| logSw: | -4.3519 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.645 |
| InChI Key: | HPPXAOAYJFQKKK-LLVKDONJSA-N |