N-(2-{3-[(3,5-dimethoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-(2-{3-[(3,5-dimethoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-(trifluoromethyl)benzamide
N-(2-{3-[(3,5-dimethoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V012-4021 |
| Compound Name: | N-(2-{3-[(3,5-dimethoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 513.52 |
| Molecular Formula: | C27 H26 F3 N3 O4 |
| Smiles: | COc1cc(CN2CCCN(C2=O)c2ccccc2NC(c2cccc(c2)C(F)(F)F)=O)cc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.2365 |
| logD: | 5.2201 |
| logSw: | -5.1085 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.977 |
| InChI Key: | VAEIQFWMEHZOMZ-UHFFFAOYSA-N |