4-[(4-methylphenyl)methyl]-3,5-dioxo-2-phenyl-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(4-methylphenyl)methyl]-3,5-dioxo-2-phenyl-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(4-methylphenyl)methyl]-3,5-dioxo-2-phenyl-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V029-7017 |
| Compound Name: | 4-[(4-methylphenyl)methyl]-3,5-dioxo-2-phenyl-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 427.46 |
| Molecular Formula: | C24 H21 N5 O3 |
| Smiles: | Cc1ccc(CN2C(C(C(NCc3ccccn3)=O)=NN(C2=O)c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0423 |
| logD: | 3.0201 |
| logSw: | -3.2594 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.201 |
| InChI Key: | WPKDSMWPGKKKJT-UHFFFAOYSA-N |