6-(4-acetylpiperazine-1-carbonyl)-2-(3,4-dimethoxyphenyl)-4-{[3-(trifluoromethyl)phenyl]methyl}-1,2,4-triazine-3,5(2H,4H)-dione
Chemical Structure Depiction of
6-(4-acetylpiperazine-1-carbonyl)-2-(3,4-dimethoxyphenyl)-4-{[3-(trifluoromethyl)phenyl]methyl}-1,2,4-triazine-3,5(2H,4H)-dione
6-(4-acetylpiperazine-1-carbonyl)-2-(3,4-dimethoxyphenyl)-4-{[3-(trifluoromethyl)phenyl]methyl}-1,2,4-triazine-3,5(2H,4H)-dione
Compound characteristics
| Compound ID: | V021-9210 |
| Compound Name: | 6-(4-acetylpiperazine-1-carbonyl)-2-(3,4-dimethoxyphenyl)-4-{[3-(trifluoromethyl)phenyl]methyl}-1,2,4-triazine-3,5(2H,4H)-dione |
| Molecular Weight: | 561.52 |
| Molecular Formula: | C26 H26 F3 N5 O6 |
| Smiles: | CC(N1CCN(CC1)C(C1C(N(Cc2cccc(c2)C(F)(F)F)C(N(c2ccc(c(c2)OC)OC)N=1)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2986 |
| logD: | 2.2986 |
| logSw: | -2.7679 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 91.35 |
| InChI Key: | XTXVZXYXNXMZCM-UHFFFAOYSA-N |