N-[(furan-2-yl)methyl]-4-[(3-methylphenyl)methyl]-3,5-dioxo-2-[4-(propan-2-yl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-4-[(3-methylphenyl)methyl]-3,5-dioxo-2-[4-(propan-2-yl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-[(furan-2-yl)methyl]-4-[(3-methylphenyl)methyl]-3,5-dioxo-2-[4-(propan-2-yl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V026-0529 |
| Compound Name: | N-[(furan-2-yl)methyl]-4-[(3-methylphenyl)methyl]-3,5-dioxo-2-[4-(propan-2-yl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 458.52 |
| Molecular Formula: | C26 H26 N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)N1C(N(Cc2cccc(C)c2)C(C(C(NCc2ccco2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3857 |
| logD: | 5.3643 |
| logSw: | -5.3223 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.407 |
| InChI Key: | LBEWPJGLJFKWCL-UHFFFAOYSA-N |