ethyl 2-{[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 2-{[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl]amino}benzoate
ethyl 2-{[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | G674-0074 |
| Compound Name: | ethyl 2-{[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl]amino}benzoate |
| Molecular Weight: | 408.41 |
| Molecular Formula: | C21 H20 N4 O5 |
| Smiles: | CCOC(c1ccccc1NC(C1C(N(C)C(N(c2ccc(C)cc2)N=1)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4256 |
| logD: | 0.2508 |
| logSw: | -3.6688 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.429 |
| InChI Key: | WXCXWPOAGUGLID-UHFFFAOYSA-N |