7-[(3-bromophenyl)methyl]-N-cycloheptyl-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-cycloheptyl-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-cycloheptyl-8-oxo-6-phenyl-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide
Compound characteristics
| Compound ID: | E236-0047 |
| Compound Name: | 7-[(3-bromophenyl)methyl]-N-cycloheptyl-8-oxo-6-phenyl-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide |
| Molecular Weight: | 576.56 |
| Molecular Formula: | C30 H30 Br N3 O2 S |
| Smiles: | C1CCCC(CC1)NC(C1(Cn2c(cc3c2ccs3)C(N1Cc1cccc(c1)[Br])=O)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.4439 |
| logD: | 7.4439 |
| logSw: | -6.0353 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.224 |
| InChI Key: | FLKIJRIQTBQBHS-SSEXGKCCSA-N |