3-amino-N-(4-cyanophenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]thieno[3,2-e]pyridine-2-carboxamide
Chemical Structure Depiction of
3-amino-N-(4-cyanophenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]thieno[3,2-e]pyridine-2-carboxamide
3-amino-N-(4-cyanophenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]thieno[3,2-e]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | 8014-0811 |
| Compound Name: | 3-amino-N-(4-cyanophenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]thieno[3,2-e]pyridine-2-carboxamide |
| Molecular Weight: | 376.48 |
| Molecular Formula: | C21 H20 N4 O S |
| Smiles: | C1CCCc2c(CC1)cc1c(c(C(Nc3ccc(C#N)cc3)=O)sc1n2)N |
| Stereo: | ACHIRAL |
| logP: | 4.7064 |
| logD: | 4.7049 |
| logSw: | -4.8083 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.245 |
| InChI Key: | LDQKZDDHMFOVRV-UHFFFAOYSA-N |