2-amino-1-(3-chloro-4-fluorophenyl)-6-ethylidene-5-methyl-4,4-bis(trifluoromethyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
2-amino-1-(3-chloro-4-fluorophenyl)-6-ethylidene-5-methyl-4,4-bis(trifluoromethyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile
2-amino-1-(3-chloro-4-fluorophenyl)-6-ethylidene-5-methyl-4,4-bis(trifluoromethyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8018-9021 |
| Compound Name: | 2-amino-1-(3-chloro-4-fluorophenyl)-6-ethylidene-5-methyl-4,4-bis(trifluoromethyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile |
| Molecular Weight: | 427.75 |
| Molecular Formula: | C17 H13 Cl F7 N3 |
| Smiles: | C\C=C1/C(C)C(C(C#N)=C(N)N1c1ccc(c(c1)[Cl])F)(C(F)(F)F)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1172 |
| logD: | 5.1172 |
| logSw: | -5.7741 |
| Hydrogen bond acceptors count: | 1 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 38.62 |
| InChI Key: | KKAUQBFXQFJVLX-QMMMGPOBSA-N |