N-{[5-(4-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-(propan-2-yl)urea
Chemical Structure Depiction of
N-{[5-(4-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-(propan-2-yl)urea
N-{[5-(4-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-(propan-2-yl)urea
Compound characteristics
| Compound ID: | V003-2653 |
| Compound Name: | N-{[5-(4-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-(propan-2-yl)urea |
| Molecular Weight: | 483.01 |
| Molecular Formula: | C26 H31 Cl N4 O3 |
| Smiles: | CC(C)NC(N(CC1CCCO1)Cc1c(C)nn(c2ccccc2)c1Oc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9798 |
| logD: | 4.9798 |
| logSw: | -5.0273 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.903 |
| InChI Key: | BOBYORCHWKDRLG-HSZRJFAPSA-N |