6-(4-benzylpiperazine-1-carbonyl)-2-(4-fluorophenyl)-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione
Chemical Structure Depiction of
6-(4-benzylpiperazine-1-carbonyl)-2-(4-fluorophenyl)-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione
6-(4-benzylpiperazine-1-carbonyl)-2-(4-fluorophenyl)-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione
Compound characteristics
| Compound ID: | G674-1559 |
| Compound Name: | 6-(4-benzylpiperazine-1-carbonyl)-2-(4-fluorophenyl)-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione |
| Molecular Weight: | 423.45 |
| Molecular Formula: | C22 H22 F N5 O3 |
| Smiles: | CN1C(C(C(N2CCN(CC2)Cc2ccccc2)=O)=NN(C1=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.091 |
| logD: | 2.0862 |
| logSw: | -2.448 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.471 |
| InChI Key: | XWSMTVLYYNIVSM-UHFFFAOYSA-N |