4-bromo-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)benzamide
Chemical Structure Depiction of
4-bromo-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)benzamide
4-bromo-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)benzamide
Compound characteristics
| Compound ID: | Y204-2586 |
| Compound Name: | 4-bromo-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)benzamide |
| Molecular Weight: | 389.31 |
| Molecular Formula: | C18 H17 Br N2 O S |
| Smiles: | C1CCCc2c(CC1)c(C#N)c(NC(c1ccc(cc1)[Br])=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.5029 |
| logD: | 1.9586 |
| logSw: | -5.7011 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.432 |
| InChI Key: | ZWLBADQEWHFLQA-UHFFFAOYSA-N |