N-[(4-methylphenyl)methyl]-12-oxo-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-9-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-12-oxo-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-9-carboxamide
N-[(4-methylphenyl)methyl]-12-oxo-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-9-carboxamide
Compound characteristics
| Compound ID: | C367-0188 |
| Compound Name: | N-[(4-methylphenyl)methyl]-12-oxo-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-9-carboxamide |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C23 H21 N3 O2 S |
| Smiles: | Cc1ccc(CNC(C2C=CC3=Nc4c(C(N3C=2)=O)c2CCCCc2s4)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.677 |
| logD: | 3.6766 |
| logSw: | -4.1328 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.24 |
| InChI Key: | YREPTUYXZDBDEJ-UHFFFAOYSA-N |