N-[1-(adamantan-1-yl)ethyl]-3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)propanamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)ethyl]-3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)propanamide
N-[1-(adamantan-1-yl)ethyl]-3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)propanamide
Compound characteristics
| Compound ID: | F145-0537 |
| Compound Name: | N-[1-(adamantan-1-yl)ethyl]-3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)propanamide |
| Molecular Weight: | 453.65 |
| Molecular Formula: | C26 H35 N3 O2 S |
| Smiles: | CC(C12CC3CC(CC(C3)C2)C1)NC(CCC1NC(c2c3CCCCCc3sc2N=1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0452 |
| logD: | 5.0446 |
| logSw: | -4.6244 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.722 |
| InChI Key: | ZBSJXVCLNXRPJT-HDOKVFJDSA-N |