N-cyclooctyl-7-(3-ethoxypropyl)-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-ethoxypropyl)-6-methyl-8-oxo-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide
N-cyclooctyl-7-(3-ethoxypropyl)-6-methyl-8-oxo-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide
Compound characteristics
Compound ID: | E021-0688 |
Compound Name: | N-cyclooctyl-7-(3-ethoxypropyl)-6-methyl-8-oxo-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide |
Molecular Weight: | 445.62 |
Molecular Formula: | C24 H35 N3 O3 S |
Smiles: | CCOCCCN1C(c2cc3c(ccs3)n2CC1(C)C(NC1CCCCCCC1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.882 |
logD: | 4.882 |
logSw: | -4.5388 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.314 |
InChI Key: | KRRDNOQTNLJJTA-DEOSSOPVSA-N |