N-cyclopentyl-3-methyl-2-{2-[4-(methylsulfanyl)phenyl]ethyl}-1-oxo-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-3-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-3-methyl-2-{2-[4-(methylsulfanyl)phenyl]ethyl}-1-oxo-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-3-carboxamide
N-cyclopentyl-3-methyl-2-{2-[4-(methylsulfanyl)phenyl]ethyl}-1-oxo-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-3-carboxamide
Compound characteristics
| Compound ID: | E636-0100 |
| Compound Name: | N-cyclopentyl-3-methyl-2-{2-[4-(methylsulfanyl)phenyl]ethyl}-1-oxo-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-3-carboxamide |
| Molecular Weight: | 487.66 |
| Molecular Formula: | C29 H33 N3 O2 S |
| Smiles: | CC1(Cn2c(ccc2c2ccccc2)C(N1CCc1ccc(cc1)SC)=O)C(NC1CCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.401 |
| logD: | 6.401 |
| logSw: | -5.6853 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.56 |
| InChI Key: | QJGOLCRHCWMMMT-LJAQVGFWSA-N |