2-(3-chloro-4-methylphenyl)-N-[(4-fluorophenyl)methyl]-4-[(2-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(3-chloro-4-methylphenyl)-N-[(4-fluorophenyl)methyl]-4-[(2-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(3-chloro-4-methylphenyl)-N-[(4-fluorophenyl)methyl]-4-[(2-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V022-0844 |
| Compound Name: | 2-(3-chloro-4-methylphenyl)-N-[(4-fluorophenyl)methyl]-4-[(2-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 492.94 |
| Molecular Formula: | C26 H22 Cl F N4 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccccc1CN1C(C(C(NCc2ccc(cc2)F)=O)=NN(C1=O)c1ccc(C)c(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5577 |
| logD: | 5.5211 |
| logSw: | -5.8834 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.658 |
| InChI Key: | DSDXDORFHQZGCN-UHFFFAOYSA-N |