N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3-(4-methoxyphenyl)propanamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3-(4-methoxyphenyl)propanamide
N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3-(4-methoxyphenyl)propanamide
Compound characteristics
| Compound ID: | Y501-4349 |
| Compound Name: | N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3-(4-methoxyphenyl)propanamide |
| Molecular Weight: | 368.5 |
| Molecular Formula: | C21 H24 N2 O2 S |
| Smiles: | COc1ccc(CCC(Nc2c(C#N)c3CCCCCCc3s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0006 |
| logD: | 3.291 |
| logSw: | -4.645 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.762 |
| InChI Key: | HWCKCCPRJRZZSW-UHFFFAOYSA-N |