N'-tert-butyl-N-{[5-(2-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-propylurea
Chemical Structure Depiction of
N'-tert-butyl-N-{[5-(2-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-propylurea
N'-tert-butyl-N-{[5-(2-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-propylurea
Compound characteristics
| Compound ID: | V001-8856 |
| Compound Name: | N'-tert-butyl-N-{[5-(2-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-propylurea |
| Molecular Weight: | 455 |
| Molecular Formula: | C25 H31 Cl N4 O2 |
| Salt: | not_available |
| Smiles: | CCCN(Cc1c(c2ccccc2)nn(C)c1Oc1ccccc1[Cl])C(NC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4983 |
| logD: | 5.4983 |
| logSw: | -5.8571 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.778 |
| InChI Key: | AGAGKXSBWXZXPN-UHFFFAOYSA-N |