6-(4-benzylpiperazine-1-carbonyl)-2-(4-chlorophenyl)-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione
Chemical Structure Depiction of
6-(4-benzylpiperazine-1-carbonyl)-2-(4-chlorophenyl)-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione
6-(4-benzylpiperazine-1-carbonyl)-2-(4-chlorophenyl)-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione
Compound characteristics
| Compound ID: | G674-0449 |
| Compound Name: | 6-(4-benzylpiperazine-1-carbonyl)-2-(4-chlorophenyl)-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione |
| Molecular Weight: | 439.9 |
| Molecular Formula: | C22 H22 Cl N5 O3 |
| Smiles: | CN1C(C(C(N2CCN(CC2)Cc2ccccc2)=O)=NN(C1=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6566 |
| logD: | 2.6518 |
| logSw: | -3.2778 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.471 |
| InChI Key: | XAQZBJABLGPFCF-UHFFFAOYSA-N |