N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-3,3-dimethyl-N-(2-methylpropyl)butanamide
Chemical Structure Depiction of
N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-3,3-dimethyl-N-(2-methylpropyl)butanamide
N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-3,3-dimethyl-N-(2-methylpropyl)butanamide
Compound characteristics
| Compound ID: | V007-6243 |
| Compound Name: | N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-3,3-dimethyl-N-(2-methylpropyl)butanamide |
| Molecular Weight: | 471.66 |
| Molecular Formula: | C27 H42 F N5 O |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)c1c(CN(CC(C)C)C(CC(C)(C)C)=O)c(C)nn1c1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 5.3648 |
| logD: | 3.2961 |
| logSw: | -5.3491 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.407 |
| InChI Key: | QPBBVRCXNKIHBP-UHFFFAOYSA-N |