N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-3,3-dimethyl-N-propylbutanamide
Chemical Structure Depiction of
N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-3,3-dimethyl-N-propylbutanamide
N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-3,3-dimethyl-N-propylbutanamide
Compound characteristics
| Compound ID: | V015-0099 |
| Compound Name: | N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-3,3-dimethyl-N-propylbutanamide |
| Molecular Weight: | 443.61 |
| Molecular Formula: | C25 H38 F N5 O |
| Smiles: | CCCN(Cc1c(C)nn(c2cccc(c2)F)c1N1CCN(C)CC1)C(CC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6349 |
| logD: | 2.7185 |
| logSw: | -4.5494 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.325 |
| InChI Key: | GQSCIMXQVRCRIM-UHFFFAOYSA-N |