N-benzyl-8-chloro-2-(2,3-dimethylphenyl)-3-methyl-1,4-dioxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Chemical Structure Depiction of
N-benzyl-8-chloro-2-(2,3-dimethylphenyl)-3-methyl-1,4-dioxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
N-benzyl-8-chloro-2-(2,3-dimethylphenyl)-3-methyl-1,4-dioxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Compound characteristics
| Compound ID: | F336-0268 |
| Compound Name: | N-benzyl-8-chloro-2-(2,3-dimethylphenyl)-3-methyl-1,4-dioxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide |
| Molecular Weight: | 485.97 |
| Molecular Formula: | C28 H24 Cl N3 O3 |
| Smiles: | Cc1cccc(c1C)N1C(c2cc3cc(ccc3n2C(C1(C)C(NCc1ccccc1)=O)=O)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4664 |
| logD: | 5.4664 |
| logSw: | -5.8868 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.015 |
| InChI Key: | PNLQWGNSQIWBOY-NDEPHWFRSA-N |