N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-2-[(pyrimidin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-2-[(pyrimidin-2-yl)sulfanyl]acetamide
N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-2-[(pyrimidin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | Y205-9629 |
| Compound Name: | N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-2-[(pyrimidin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 358.48 |
| Molecular Formula: | C17 H18 N4 O S2 |
| Smiles: | C1CCCc2c(CC1)c(C#N)c(NC(CSc1ncccn1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.4598 |
| logD: | 2.427 |
| logSw: | -3.8973 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.376 |
| InChI Key: | SBDMIBIOJVPRMG-UHFFFAOYSA-N |