N-(2-{3-[(2-chloro-5-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-5-methylphenyl)-N'-ethylurea
Chemical Structure Depiction of
N-(2-{3-[(2-chloro-5-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-5-methylphenyl)-N'-ethylurea
N-(2-{3-[(2-chloro-5-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-5-methylphenyl)-N'-ethylurea
Compound characteristics
| Compound ID: | V020-6680 |
| Compound Name: | N-(2-{3-[(2-chloro-5-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-5-methylphenyl)-N'-ethylurea |
| Molecular Weight: | 418.9 |
| Molecular Formula: | C21 H24 Cl F N4 O2 |
| Smiles: | CCNC(Nc1cc(C)ccc1N1CCCN(Cc2cc(ccc2[Cl])F)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3728 |
| logD: | 4.3728 |
| logSw: | -4.4398 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.321 |
| InChI Key: | CVAFAVULBWWENW-UHFFFAOYSA-N |