N-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]benzenesulfonamide
Chemical Structure Depiction of
N-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]benzenesulfonamide
N-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]benzenesulfonamide
Compound characteristics
| Compound ID: | V019-4004 |
| Compound Name: | N-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]benzenesulfonamide |
| Molecular Weight: | 503.54 |
| Molecular Formula: | C25 H24 F3 N3 O3 S |
| Smiles: | Cc1ccc(c(c1)NS(c1ccccc1)(=O)=O)N1CCCN(Cc2cccc(c2)C(F)(F)F)C1=O |
| Stereo: | ACHIRAL |
| logP: | 4.9469 |
| logD: | 4.4912 |
| logSw: | -4.6796 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.448 |
| InChI Key: | PDKAURCPLIVPTB-UHFFFAOYSA-N |