2-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
2-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | F145-0573 |
| Compound Name: | 2-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 449.61 |
| Molecular Formula: | C26 H31 N3 O2 S |
| Smiles: | C1CCc2c3C(NC(CCC(N4CCC(CC4)Cc4ccccc4)=O)=Nc3sc2CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9654 |
| logD: | 4.9648 |
| logSw: | -4.8884 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.175 |
| InChI Key: | ULTYUFGPOGFDAT-UHFFFAOYSA-N |