N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3-phenylpropanamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3-phenylpropanamide
N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3-phenylpropanamide
Compound characteristics
| Compound ID: | 3112-5271 |
| Compound Name: | N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3-phenylpropanamide |
| Molecular Weight: | 338.47 |
| Molecular Formula: | C20 H22 N2 O S |
| Smiles: | C1CCCc2c(CC1)c(C#N)c(NC(CCc1ccccc1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.0182 |
| logD: | 3.3086 |
| logSw: | -4.8924 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.218 |
| InChI Key: | QOLGQENCBUTYGJ-UHFFFAOYSA-N |