N-[(4-methoxyphenyl)methyl]-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-[(4-methoxyphenyl)methyl]-12-oxo-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-7-carboxamide
N-[(4-methoxyphenyl)methyl]-12-oxo-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | C367-0038 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-12-oxo-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-7-carboxamide |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C23 H21 N3 O3 S |
| Smiles: | COc1ccc(CNC(C2=CC=CN3C2=Nc2c(C3=O)c3CCCCc3s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2277 |
| logD: | 3.2276 |
| logSw: | -3.7022 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.285 |
| InChI Key: | FMMSZGAGHFNXOF-UHFFFAOYSA-N |