N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)-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-methoxypropyl)-N'-(3-methylphenyl)urea
N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)-N'-(3-methylphenyl)urea
Compound characteristics
| Compound ID: | V001-0245 |
| Compound Name: | N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)-N'-(3-methylphenyl)urea |
| Molecular Weight: | 504.68 |
| Molecular Formula: | C29 H40 N6 O2 |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)c1c(CN(CCCOC)C(Nc2cccc(C)c2)=O)c(C)nn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4267 |
| logD: | 2.358 |
| logSw: | -4.1982 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.804 |
| InChI Key: | OBMPURALKNPKAW-UHFFFAOYSA-N |