N-(2,5-difluorophenyl)-2-({6-[(4-fluorophenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2,5-difluorophenyl)-2-({6-[(4-fluorophenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamide
N-(2,5-difluorophenyl)-2-({6-[(4-fluorophenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | E140-0876 |
| Compound Name: | N-(2,5-difluorophenyl)-2-({6-[(4-fluorophenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 460.48 |
| Molecular Formula: | C22 H19 F3 N4 O2 S |
| Smiles: | C1CN(CC2=C1N=C(NC2=O)SCC(Nc1cc(ccc1F)F)=O)Cc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 2.7296 |
| logD: | 2.1802 |
| logSw: | -3.1419 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.397 |
| InChI Key: | XQEJCNBLJCTBPD-UHFFFAOYSA-N |