N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | G674-0273 |
| Compound Name: | N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 490.61 |
| Molecular Formula: | C27 H34 N6 O3 |
| Smiles: | Cc1ccc(cc1)N1C(N(C)C(C(C(NCCCN2CCN(CC2)c2cc(C)ccc2C)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6661 |
| logD: | 2.5195 |
| logSw: | -3.8248 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.479 |
| InChI Key: | HPXNNXOSWFCMNW-UHFFFAOYSA-N |