N-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-[4-(propan-2-yl)phenyl]urea
Chemical Structure Depiction of
N-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-[4-(propan-2-yl)phenyl]urea
N-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-[4-(propan-2-yl)phenyl]urea
Compound characteristics
| Compound ID: | V020-2847 |
| Compound Name: | N-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-[4-(propan-2-yl)phenyl]urea |
| Molecular Weight: | 540.59 |
| Molecular Formula: | C29 H31 F3 N4 O3 |
| Smiles: | CC(C)c1ccc(cc1)NC(Nc1cc(C)ccc1N1CCCN(Cc2cccc(c2)OC(F)(F)F)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.6099 |
| logD: | 7.6099 |
| logSw: | -5.6039 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.038 |
| InChI Key: | FJPSXZSMOIITAX-UHFFFAOYSA-N |