4-[(4-methylphenyl)methyl]-3,5-dioxo-N-[(oxolan-2-yl)methyl]-2-[4-(propan-2-yl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(4-methylphenyl)methyl]-3,5-dioxo-N-[(oxolan-2-yl)methyl]-2-[4-(propan-2-yl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(4-methylphenyl)methyl]-3,5-dioxo-N-[(oxolan-2-yl)methyl]-2-[4-(propan-2-yl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V026-0493 |
| Compound Name: | 4-[(4-methylphenyl)methyl]-3,5-dioxo-N-[(oxolan-2-yl)methyl]-2-[4-(propan-2-yl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C26 H30 N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)N1C(N(Cc2ccc(C)cc2)C(C(C(NCC2CCCO2)=O)=N1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9625 |
| logD: | 3.9615 |
| logSw: | -3.8828 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.313 |
| InChI Key: | CNDQWGDQHWHKBT-JOCHJYFZSA-N |