3-(2-chlorophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
3-(2-chlorophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
3-(2-chlorophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | 8009-5648 |
| Compound Name: | 3-(2-chlorophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 397.88 |
| Molecular Formula: | C20 H16 Cl N3 O2 S |
| Smiles: | Cc1c(C(Nc2c(C#N)c3CCCCc3s2)=O)c(c2ccccc2[Cl])no1 |
| Stereo: | ACHIRAL |
| logP: | 4.5086 |
| logD: | 1.7557 |
| logSw: | -4.8238 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.061 |
| InChI Key: | IEYTVLZRFYNCEB-UHFFFAOYSA-N |