5-amino-1-phenyl-3,3-bis(trifluoromethyl)-2,3-dihydro-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-1-phenyl-3,3-bis(trifluoromethyl)-2,3-dihydro-1H-pyrazole-4-carbonitrile
5-amino-1-phenyl-3,3-bis(trifluoromethyl)-2,3-dihydro-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8010-8294 |
| Compound Name: | 5-amino-1-phenyl-3,3-bis(trifluoromethyl)-2,3-dihydro-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 322.21 |
| Molecular Formula: | C12 H8 F6 N4 |
| Smiles: | C(C1=C(N)N(c2ccccc2)NC1(C(F)(F)F)C(F)(F)F)#N |
| Stereo: | ACHIRAL |
| logP: | 2.7427 |
| logD: | 2.7427 |
| logSw: | -2.8693 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 54.582 |
| InChI Key: | LSLGPAPUUKSHRP-UHFFFAOYSA-N |