N'-ethyl-N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)urea
Chemical Structure Depiction of
N'-ethyl-N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)urea
N'-ethyl-N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)urea
Compound characteristics
| Compound ID: | V015-0075 |
| Compound Name: | N'-ethyl-N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)urea |
| Molecular Weight: | 440.63 |
| Molecular Formula: | C25 H40 N6 O |
| Smiles: | CCNC(N(CCC(C)C)Cc1c(C)nn(c2ccccc2)c1N1CCN(CC)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0667 |
| logD: | 1.998 |
| logSw: | -3.8951 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.681 |
| InChI Key: | XGQORXNZFCZRRA-UHFFFAOYSA-N |