N-cyclooctyl-7-(3-fluorophenyl)-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-fluorophenyl)-6-methyl-8-oxo-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide
N-cyclooctyl-7-(3-fluorophenyl)-6-methyl-8-oxo-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide
Compound characteristics
| Compound ID: | E021-0656 |
| Compound Name: | N-cyclooctyl-7-(3-fluorophenyl)-6-methyl-8-oxo-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide |
| Molecular Weight: | 453.58 |
| Molecular Formula: | C25 H28 F N3 O2 S |
| Smiles: | CC1(Cn2c(cc3c2ccs3)C(N1c1cccc(c1)F)=O)C(NC1CCCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.596 |
| logD: | 5.596 |
| logSw: | -5.2787 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.475 |
| InChI Key: | KNUJWEPHKGJIKI-VWLOTQADSA-N |