7-[(3-bromophenyl)methyl]-N-cyclooctyl-2-ethyl-8-oxo-6-phenyl-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide
Chemical Structure Depiction of
7-[(3-bromophenyl)methyl]-N-cyclooctyl-2-ethyl-8-oxo-6-phenyl-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide
7-[(3-bromophenyl)methyl]-N-cyclooctyl-2-ethyl-8-oxo-6-phenyl-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide
Compound characteristics
| Compound ID: | E236-0083 |
| Compound Name: | 7-[(3-bromophenyl)methyl]-N-cyclooctyl-2-ethyl-8-oxo-6-phenyl-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide |
| Molecular Weight: | 618.64 |
| Molecular Formula: | C33 H36 Br N3 O2 S |
| Smiles: | CCc1cc2c(cc3C(N(Cc4cccc(c4)[Br])C(Cn23)(C(NC2CCCCCCC2)=O)c2ccccc2)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.851 |
| logD: | 8.851 |
| logSw: | -5.5294 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.224 |
| InChI Key: | AFFJWHNFPAATGV-MGBGTMOVSA-N |