N-benzyl-N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}-N'-(propan-2-yl)urea
Chemical Structure Depiction of
N-benzyl-N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}-N'-(propan-2-yl)urea
N-benzyl-N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}-N'-(propan-2-yl)urea
Compound characteristics
| Compound ID: | V002-9557 |
| Compound Name: | N-benzyl-N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}-N'-(propan-2-yl)urea |
| Molecular Weight: | 489.02 |
| Molecular Formula: | C28 H29 Cl N4 O2 |
| Smiles: | CC(C)NC(N(Cc1ccccc1)Cc1c(C)nn(c2cccc(c2)[Cl])c1Oc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3928 |
| logD: | 6.3928 |
| logSw: | -6.1589 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.248 |
| InChI Key: | HYSUCQIIGUIQBQ-UHFFFAOYSA-N |