N-cyclooctyl-7-(3,4-dimethylphenyl)-6-methyl-8-oxo-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide
Chemical Structure Depiction of
N-cyclooctyl-7-(3,4-dimethylphenyl)-6-methyl-8-oxo-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide
N-cyclooctyl-7-(3,4-dimethylphenyl)-6-methyl-8-oxo-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide
Compound characteristics
| Compound ID: | E021-0671 |
| Compound Name: | N-cyclooctyl-7-(3,4-dimethylphenyl)-6-methyl-8-oxo-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide |
| Molecular Weight: | 463.64 |
| Molecular Formula: | C27 H33 N3 O2 S |
| Smiles: | Cc1ccc(cc1C)N1C(c2cc3c(ccs3)n2CC1(C)C(NC1CCCCCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.6531 |
| logD: | 6.6531 |
| logSw: | -5.4487 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.475 |
| InChI Key: | KELIPWBLFLBYCW-MHZLTWQESA-N |