4-[(2-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-2-(3-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(2-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-2-(3-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(2-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-2-(3-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V005-9200 |
| Compound Name: | 4-[(2-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-2-(3-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 450.88 |
| Molecular Formula: | C23 H19 Cl N4 O4 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)N1C(N(Cc2ccccc2[Cl])C(C(C(NCc2ccco2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.388 |
| logD: | 4.3667 |
| logSw: | -4.4445 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.407 |
| InChI Key: | JHBSMTVGHYOMJO-UHFFFAOYSA-N |