N-(cyclopropylmethyl)-3,5-dioxo-2-[4-(trifluoromethyl)phenyl]-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-(cyclopropylmethyl)-3,5-dioxo-2-[4-(trifluoromethyl)phenyl]-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-(cyclopropylmethyl)-3,5-dioxo-2-[4-(trifluoromethyl)phenyl]-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V023-0092 |
| Compound Name: | N-(cyclopropylmethyl)-3,5-dioxo-2-[4-(trifluoromethyl)phenyl]-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 512.41 |
| Molecular Formula: | C23 H18 F6 N4 O3 |
| Smiles: | C1CC1CNC(C1C(N(Cc2ccc(cc2)C(F)(F)F)C(N(c2ccc(cc2)C(F)(F)F)N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7264 |
| logD: | 4.7264 |
| logSw: | -4.786 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.181 |
| InChI Key: | DKOGBHKMVGEALW-UHFFFAOYSA-N |