4-[(2-chlorophenyl)methyl]-2-(4-methylphenyl)-6-(4-methylpiperazine-1-carbonyl)-1,2,4-triazine-3,5(2H,4H)-dione
Chemical Structure Depiction of
4-[(2-chlorophenyl)methyl]-2-(4-methylphenyl)-6-(4-methylpiperazine-1-carbonyl)-1,2,4-triazine-3,5(2H,4H)-dione
4-[(2-chlorophenyl)methyl]-2-(4-methylphenyl)-6-(4-methylpiperazine-1-carbonyl)-1,2,4-triazine-3,5(2H,4H)-dione
Compound characteristics
| Compound ID: | V009-4857 |
| Compound Name: | 4-[(2-chlorophenyl)methyl]-2-(4-methylphenyl)-6-(4-methylpiperazine-1-carbonyl)-1,2,4-triazine-3,5(2H,4H)-dione |
| Molecular Weight: | 453.93 |
| Molecular Formula: | C23 H24 Cl N5 O3 |
| Smiles: | Cc1ccc(cc1)N1C(N(Cc2ccccc2[Cl])C(C(C(N2CCN(C)CC2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9625 |
| logD: | 2.918 |
| logSw: | -3.3422 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.37 |
| InChI Key: | CJTNUCNAFCIJPM-UHFFFAOYSA-N |