N-(pyrimidin-2-yl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide
Chemical Structure Depiction of
N-(pyrimidin-2-yl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide
N-(pyrimidin-2-yl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y205-4788 |
| Compound Name: | N-(pyrimidin-2-yl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide |
| Molecular Weight: | 287.38 |
| Molecular Formula: | C15 H17 N3 O S |
| Smiles: | C1CCCc2c(CC1)cc(C(Nc1ncccn1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.2711 |
| logD: | 3.2678 |
| logSw: | -3.3967 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.169 |
| InChI Key: | JXBYLGDAQBTRCU-UHFFFAOYSA-N |