N-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-(prop-2-en-1-yl)urea
Chemical Structure Depiction of
N-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-(prop-2-en-1-yl)urea
N-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-(prop-2-en-1-yl)urea
Compound characteristics
| Compound ID: | V018-8037 |
| Compound Name: | N-[5-methyl-2-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-(prop-2-en-1-yl)urea |
| Molecular Weight: | 462.47 |
| Molecular Formula: | C23 H25 F3 N4 O3 |
| Smiles: | Cc1ccc(c(c1)NC(NCC=C)=O)N1CCCN(Cc2cccc(c2)OC(F)(F)F)C1=O |
| Stereo: | ACHIRAL |
| logP: | 4.6105 |
| logD: | 4.6105 |
| logSw: | -4.4478 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.473 |
| InChI Key: | BIQPPASGDAKWGW-UHFFFAOYSA-N |