N-(2-chloro-5-{3-[(3,4-difluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-methoxybenzamide
Chemical Structure Depiction of
N-(2-chloro-5-{3-[(3,4-difluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-methoxybenzamide
N-(2-chloro-5-{3-[(3,4-difluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-methoxybenzamide
Compound characteristics
| Compound ID: | V029-0241 |
| Compound Name: | N-(2-chloro-5-{3-[(3,4-difluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-methoxybenzamide |
| Molecular Weight: | 485.92 |
| Molecular Formula: | C25 H22 Cl F2 N3 O3 |
| Smiles: | COc1cccc(c1)C(Nc1cc(ccc1[Cl])N1CCCN(Cc2ccc(c(c2)F)F)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0733 |
| logD: | 5.064 |
| logSw: | -5.5575 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.734 |
| InChI Key: | AQBLUHGWZWRNSN-UHFFFAOYSA-N |