N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-(2-chlorophenyl)-2H-tetrazol-2-yl]acetamide
Chemical Structure Depiction of
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-(2-chlorophenyl)-2H-tetrazol-2-yl]acetamide
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-(2-chlorophenyl)-2H-tetrazol-2-yl]acetamide
Compound characteristics
| Compound ID: | 8017-0245 |
| Compound Name: | N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-(2-chlorophenyl)-2H-tetrazol-2-yl]acetamide |
| Molecular Weight: | 454.98 |
| Molecular Formula: | C22 H23 Cl N6 O S |
| Smiles: | CC(C)(C)C1CCc2c(C#N)c(NC(Cn3nc(c4ccccc4[Cl])nn3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2368 |
| logD: | 4.4257 |
| logSw: | -5.4989 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.262 |
| InChI Key: | JSPVLXXIMFMLNW-CYBMUJFWSA-N |