N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-(2-methylphenyl)-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-methylphenyl)-2H-tetrazol-2-yl]acetamide
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-(2-methylphenyl)-2H-tetrazol-2-yl]acetamide
Compound characteristics
| Compound ID: | 8016-8880 |
| Compound Name: | N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-(2-methylphenyl)-2H-tetrazol-2-yl]acetamide |
| Molecular Weight: | 434.56 |
| Molecular Formula: | C23 H26 N6 O S |
| Smiles: | Cc1ccccc1c1nnn(CC(Nc2c(C#N)c3CCC(Cc3s2)C(C)(C)C)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0885 |
| logD: | 4.2774 |
| logSw: | -4.8356 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.262 |
| InChI Key: | DWXPGEUTNAZLMQ-OAHLLOKOSA-N |