N-cyclooctyl-6-methyl-7-[(4-methylphenyl)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-6-methyl-7-[(4-methylphenyl)methyl]-8-oxo-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide
N-cyclooctyl-6-methyl-7-[(4-methylphenyl)methyl]-8-oxo-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide
Compound characteristics
Compound ID: | E021-0660 |
Compound Name: | N-cyclooctyl-6-methyl-7-[(4-methylphenyl)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(CN2C(c3cc4c(ccs4)n3CC2(C)C(NC2CCCCCCC2)=O)=O)cc1 |
Stereo: | RACEMIC MIXTURE |
logP: | 6.4095 |
logD: | 6.4095 |
logSw: | -5.4453 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.086 |
InChI Key: | DMLPWZFGGZKGTO-MHZLTWQESA-N |