N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | Y203-3531 |
| Compound Name: | N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 378.54 |
| Molecular Formula: | C16 H18 N4 O S3 |
| Smiles: | CCC1CCc2c(C#N)c(NC(CSc3nnc(C)s3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6857 |
| logD: | 2.6286 |
| logSw: | -4.2088 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.559 |
| InChI Key: | LQGYACDDTLBGNI-SNVBAGLBSA-N |