N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)-N'-(3-methylphenyl)urea
Chemical Structure Depiction of
N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)-N'-(3-methylphenyl)urea
N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)-N'-(3-methylphenyl)urea
Compound characteristics
| Compound ID: | V006-8618 |
| Compound Name: | N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)-N'-(3-methylphenyl)urea |
| Molecular Weight: | 502.7 |
| Molecular Formula: | C30 H42 N6 O |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)c1c(CN(CCC(C)C)C(Nc2cccc(C)c2)=O)c(C)nn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8001 |
| logD: | 3.7314 |
| logSw: | -5.4334 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.462 |
| InChI Key: | NZVYBIPWFPMIKZ-UHFFFAOYSA-N |