N-[3-(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-[3-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-(prop-2-en-1-yl)urea
N-[3-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-(prop-2-en-1-yl)urea
Compound characteristics
| Compound ID: | V021-1390 |
| Compound Name: | N-[3-(2-oxo-3-{[3-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-N'-(prop-2-en-1-yl)urea |
| Molecular Weight: | 448.44 |
| Molecular Formula: | C22 H23 F3 N4 O3 |
| Smiles: | C=CCNC(Nc1cccc(c1)N1CCCN(Cc2cccc(c2)OC(F)(F)F)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6274 |
| logD: | 4.6274 |
| logSw: | -4.6272 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.472 |
| InChI Key: | XDBLHDKERNWWDX-UHFFFAOYSA-N |