methyl 4-{[2-(4-fluorophenyl)-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-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl]amino}benzoate
methyl 4-{[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | G674-1776 |
| Compound Name: | methyl 4-{[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl]amino}benzoate |
| Molecular Weight: | 398.35 |
| Molecular Formula: | C19 H15 F N4 O5 |
| Smiles: | CN1C(C(C(Nc2ccc(cc2)C(=O)OC)=O)=NN(C1=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6555 |
| logD: | 1.6528 |
| logSw: | -3.2812 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.547 |
| InChI Key: | KEXWSEIFIJKXEE-UHFFFAOYSA-N |