N-[2-(4-benzylpiperidin-1-yl)ethyl]-12-oxo-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-7-carboxamide
Chemical Structure Depiction of
N-[2-(4-benzylpiperidin-1-yl)ethyl]-12-oxo-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-7-carboxamide
N-[2-(4-benzylpiperidin-1-yl)ethyl]-12-oxo-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | C367-0118 |
| Compound Name: | N-[2-(4-benzylpiperidin-1-yl)ethyl]-12-oxo-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-7-carboxamide |
| Molecular Weight: | 500.66 |
| Molecular Formula: | C29 H32 N4 O2 S |
| Smiles: | C1CCc2c(C1)c1C(N3C=CC=C(C3=Nc1s2)C(NCCN1CCC(CC1)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4556 |
| logD: | 3.0934 |
| logSw: | -4.5103 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.294 |
| InChI Key: | KMSDYFHRWIBGKZ-UHFFFAOYSA-N |