N-[(4-fluorophenyl)methyl]-6,8-dimethyl-2-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1-oxo-1,2-dihydropyrrolo[1,2-d][1,2,4]triazine-7-carboxamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-6,8-dimethyl-2-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1-oxo-1,2-dihydropyrrolo[1,2-d][1,2,4]triazine-7-carboxamide
N-[(4-fluorophenyl)methyl]-6,8-dimethyl-2-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1-oxo-1,2-dihydropyrrolo[1,2-d][1,2,4]triazine-7-carboxamide
Compound characteristics
| Compound ID: | L982-0187 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-6,8-dimethyl-2-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1-oxo-1,2-dihydropyrrolo[1,2-d][1,2,4]triazine-7-carboxamide |
| Molecular Weight: | 475.52 |
| Molecular Formula: | C26 H26 F N5 O3 |
| Smiles: | [H]C1=NN(CC(NCc2ccc(C)cc2)=O)C(c2c(C)c(C(NCc3ccc(cc3)F)=O)c(C)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2483 |
| logD: | 2.2434 |
| logSw: | -2.7288 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.841 |
| InChI Key: | WVAKHWUSQLSTMT-UHFFFAOYSA-N |