N-benzyl-N-{[1-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}-N'-(propan-2-yl)urea
Chemical Structure Depiction of
N-benzyl-N-{[1-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}-N'-(propan-2-yl)urea
N-benzyl-N-{[1-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}-N'-(propan-2-yl)urea
Compound characteristics
| Compound ID: | V001-0877 |
| Compound Name: | N-benzyl-N-{[1-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}-N'-(propan-2-yl)urea |
| Molecular Weight: | 519.04 |
| Molecular Formula: | C29 H31 Cl N4 O3 |
| Smiles: | CC(C)NC(N(Cc1ccccc1)Cc1c(C)nn(c2cccc(c2)[Cl])c1Oc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4037 |
| logD: | 6.4037 |
| logSw: | -6.167 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.792 |
| InChI Key: | SAJOBMQLVQSPPH-UHFFFAOYSA-N |