2-(3,4-dimethylphenyl)-4-[(4-methylphenyl)methyl]-3,5-dioxo-N-[2-(pyridin-2-yl)ethyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-4-[(4-methylphenyl)methyl]-3,5-dioxo-N-[2-(pyridin-2-yl)ethyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(3,4-dimethylphenyl)-4-[(4-methylphenyl)methyl]-3,5-dioxo-N-[2-(pyridin-2-yl)ethyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V022-0254 |
| Compound Name: | 2-(3,4-dimethylphenyl)-4-[(4-methylphenyl)methyl]-3,5-dioxo-N-[2-(pyridin-2-yl)ethyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 469.54 |
| Molecular Formula: | C27 H27 N5 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(CN2C(C(C(NCCc3ccccn3)=O)=NN(C2=O)c2ccc(C)c(C)c2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2365 |
| logD: | 4.2358 |
| logSw: | -4.1238 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.043 |
| InChI Key: | UWLPWXQZSCZSBO-UHFFFAOYSA-N |