N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)-3,3-dimethylbutanamide
Chemical Structure Depiction of
N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)-3,3-dimethylbutanamide
N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)-3,3-dimethylbutanamide
Compound characteristics
| Compound ID: | V017-9855 |
| Compound Name: | N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)-3,3-dimethylbutanamide |
| Molecular Weight: | 473.63 |
| Molecular Formula: | C26 H40 F N5 O2 |
| Salt: | not_available |
| Smiles: | Cc1c(CN(CCCOC)C(CC(C)(C)C)=O)c(N2CCN(C)CC2)n(c2cccc(c2)F)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0971 |
| logD: | 2.1807 |
| logSw: | -4.351 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.667 |
| InChI Key: | KALDYDPMNZNMQG-UHFFFAOYSA-N |