6-methyl-2-(3-methylphenyl)-4,4-bis(trifluoromethyl)-1,4-dihydropyrimidine-5-carbonitrile
Chemical Structure Depiction of
6-methyl-2-(3-methylphenyl)-4,4-bis(trifluoromethyl)-1,4-dihydropyrimidine-5-carbonitrile
6-methyl-2-(3-methylphenyl)-4,4-bis(trifluoromethyl)-1,4-dihydropyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | 7591-0377 |
| Compound Name: | 6-methyl-2-(3-methylphenyl)-4,4-bis(trifluoromethyl)-1,4-dihydropyrimidine-5-carbonitrile |
| Molecular Weight: | 347.26 |
| Molecular Formula: | C15 H11 F6 N3 |
| Smiles: | CC1=C(C#N)C(C(F)(F)F)(C(F)(F)F)N=C(c2cccc(C)c2)N1 |
| Stereo: | ACHIRAL |
| logP: | 4.0416 |
| logD: | 4.0416 |
| logSw: | -4.1034 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.081 |
| InChI Key: | GWCVVSJNTYZWNL-UHFFFAOYSA-N |