methyl 4-{[2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl]amino}benzoate
methyl 4-{[2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | G674-0659 |
| Compound Name: | methyl 4-{[2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl]amino}benzoate |
| Molecular Weight: | 414.8 |
| Molecular Formula: | C19 H15 Cl N4 O5 |
| Smiles: | CN1C(C(C(Nc2ccc(cc2)C(=O)OC)=O)=NN(C1=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2212 |
| logD: | 2.2185 |
| logSw: | -3.8723 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.547 |
| InChI Key: | LGPMIJFLDCVSHU-UHFFFAOYSA-N |