N-benzyl-6,8-dimethyl-2-[2-(2-methylanilino)-2-oxoethyl]-1-oxo-1,2-dihydropyrrolo[1,2-d][1,2,4]triazine-7-carboxamide
Chemical Structure Depiction of
N-benzyl-6,8-dimethyl-2-[2-(2-methylanilino)-2-oxoethyl]-1-oxo-1,2-dihydropyrrolo[1,2-d][1,2,4]triazine-7-carboxamide
N-benzyl-6,8-dimethyl-2-[2-(2-methylanilino)-2-oxoethyl]-1-oxo-1,2-dihydropyrrolo[1,2-d][1,2,4]triazine-7-carboxamide
Compound characteristics
| Compound ID: | L982-0049 |
| Compound Name: | N-benzyl-6,8-dimethyl-2-[2-(2-methylanilino)-2-oxoethyl]-1-oxo-1,2-dihydropyrrolo[1,2-d][1,2,4]triazine-7-carboxamide |
| Molecular Weight: | 443.5 |
| Molecular Formula: | C25 H25 N5 O3 |
| Smiles: | [H]C1=NN(CC(Nc2ccccc2C)=O)C(c2c(C)c(C(NCc3ccccc3)=O)c(C)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0129 |
| logD: | 2.0111 |
| logSw: | -2.3731 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.821 |
| InChI Key: | YIMDLAYFWZSIEP-UHFFFAOYSA-N |