N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)-3,5-bis(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)-3,5-bis(trifluoromethyl)benzamide
N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)-3,5-bis(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V001-6615 |
| Compound Name: | N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)-3,5-bis(trifluoromethyl)benzamide |
| Molecular Weight: | 615.59 |
| Molecular Formula: | C29 H32 F7 N5 O2 |
| Salt: | not_available |
| Smiles: | Cc1c(CN(CCCOC)C(c2cc(cc(c2)C(F)(F)F)C(F)(F)F)=O)c(N2CCN(C)CC2)n(c2cccc(c2)F)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2405 |
| logD: | 3.3241 |
| logSw: | -5.1243 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.923 |
| InChI Key: | XUHUFSQUHKRABB-UHFFFAOYSA-N |