N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)thiophene-2-carboxamide
N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | F880-0608 |
| Compound Name: | N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)thiophene-2-carboxamide |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C21 H17 N3 O2 S2 |
| Smiles: | CC1=CC=CN2C1=NC(CSc1ccccc1NC(c1cccs1)=O)=CC2=O |
| Stereo: | ACHIRAL |
| logP: | 3.4758 |
| logD: | 3.4758 |
| logSw: | -3.7079 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.386 |
| InChI Key: | HDHPWLZAEBEOGV-UHFFFAOYSA-N |