N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | D282-0144 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 379.5 |
| Molecular Formula: | C20 H17 N3 O S2 |
| Smiles: | Cc1c(C(Nc2c(C#N)c3CCCCc3s2)=O)sc(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.932 |
| logD: | 2.5924 |
| logSw: | -4.7496 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.412 |
| InChI Key: | LHRCGSPQQYICMM-UHFFFAOYSA-N |