N-[5-methyl-2-(2-oxo-3-{[4-(trifluoromethyl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-phenylurea
Chemical Structure Depiction of
N-[5-methyl-2-(2-oxo-3-{[4-(trifluoromethyl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-phenylurea
N-[5-methyl-2-(2-oxo-3-{[4-(trifluoromethyl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-phenylurea
Compound characteristics
| Compound ID: | V020-3685 |
| Compound Name: | N-[5-methyl-2-(2-oxo-3-{[4-(trifluoromethyl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-phenylurea |
| Molecular Weight: | 482.5 |
| Molecular Formula: | C26 H25 F3 N4 O2 |
| Smiles: | Cc1ccc(c(c1)NC(Nc1ccccc1)=O)N1CCCN(Cc2ccc(cc2)C(F)(F)F)C1=O |
| Stereo: | ACHIRAL |
| logP: | 5.7737 |
| logD: | 5.7736 |
| logSw: | -5.472 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.101 |
| InChI Key: | KISPIGUZHIPQPJ-UHFFFAOYSA-N |