N-(2H-1,3-benzodioxol-5-yl)-2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | G674-0727 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 400.78 |
| Molecular Formula: | C18 H13 Cl N4 O5 |
| Smiles: | CN1C(C(C(Nc2ccc3c(c2)OCO3)=O)=NN(C1=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9636 |
| logD: | 2.2895 |
| logSw: | -3.6722 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.489 |
| InChI Key: | XVEULVVLESWRTJ-UHFFFAOYSA-N |