N-{[1-(4-chlorophenyl)-5-(3-fluorophenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-(propan-2-yl)urea
Chemical Structure Depiction of
N-{[1-(4-chlorophenyl)-5-(3-fluorophenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-(propan-2-yl)urea
N-{[1-(4-chlorophenyl)-5-(3-fluorophenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-(propan-2-yl)urea
Compound characteristics
| Compound ID: | V002-3867 |
| Compound Name: | N-{[1-(4-chlorophenyl)-5-(3-fluorophenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-(propan-2-yl)urea |
| Molecular Weight: | 501 |
| Molecular Formula: | C26 H30 Cl F N4 O3 |
| Smiles: | CC(C)NC(N(CC1CCCO1)Cc1c(C)nn(c2ccc(cc2)[Cl])c1Oc1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1243 |
| logD: | 5.1243 |
| logSw: | -5.5328 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.903 |
| InChI Key: | JBSGVQNKQCKCLJ-HSZRJFAPSA-N |