(4-nitro-1H-pyrazol-3-yl)(4-{[3-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone
Chemical Structure Depiction of
(4-nitro-1H-pyrazol-3-yl)(4-{[3-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone
(4-nitro-1H-pyrazol-3-yl)(4-{[3-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone
Compound characteristics
| Compound ID: | Y502-3591 |
| Compound Name: | (4-nitro-1H-pyrazol-3-yl)(4-{[3-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone |
| Molecular Weight: | 383.33 |
| Molecular Formula: | C16 H16 F3 N5 O3 |
| Smiles: | C1CN(CCN1Cc1cccc(c1)C(F)(F)F)C(c1c(c[nH]n1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.911 |
| logD: | 1.8721 |
| logSw: | -2.6106 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.969 |
| InChI Key: | ADCCZZIWFQHCPB-UHFFFAOYSA-N |