2-(3,4-dimethylphenyl)-4-[(3-methylphenyl)methyl]-3,5-dioxo-N-[(pyridin-4-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-4-[(3-methylphenyl)methyl]-3,5-dioxo-N-[(pyridin-4-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(3,4-dimethylphenyl)-4-[(3-methylphenyl)methyl]-3,5-dioxo-N-[(pyridin-4-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V020-7158 |
| Compound Name: | 2-(3,4-dimethylphenyl)-4-[(3-methylphenyl)methyl]-3,5-dioxo-N-[(pyridin-4-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 455.52 |
| Molecular Formula: | C26 H25 N5 O3 |
| Smiles: | Cc1cccc(CN2C(C(C(NCc3ccncc3)=O)=NN(C2=O)c2ccc(C)c(C)c2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.0776 |
| logD: | 4.069 |
| logSw: | -4.0158 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.086 |
| InChI Key: | JWECWKOIOQZAOP-UHFFFAOYSA-N |