N'-(4-chlorophenyl)-N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)urea
Chemical Structure Depiction of
N'-(4-chlorophenyl)-N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)urea
N'-(4-chlorophenyl)-N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)urea
Compound characteristics
| Compound ID: | V002-5331 |
| Compound Name: | N'-(4-chlorophenyl)-N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)urea |
| Molecular Weight: | 523.12 |
| Molecular Formula: | C29 H39 Cl N6 O |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)c1c(CN(CCC(C)C)C(Nc2ccc(cc2)[Cl])=O)c(C)nn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.0349 |
| logD: | 3.9662 |
| logSw: | -6.0403 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.462 |
| InChI Key: | HTZOXJNARSJCAY-UHFFFAOYSA-N |