N-cycloheptyl-6-(furan-2-yl)-3-methyl-2-{[4-(methylsulfanyl)phenyl]methyl}-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-3-carboxamide
Chemical Structure Depiction of
N-cycloheptyl-6-(furan-2-yl)-3-methyl-2-{[4-(methylsulfanyl)phenyl]methyl}-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-3-carboxamide
N-cycloheptyl-6-(furan-2-yl)-3-methyl-2-{[4-(methylsulfanyl)phenyl]methyl}-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-3-carboxamide
Compound characteristics
| Compound ID: | C799-0454 |
| Compound Name: | N-cycloheptyl-6-(furan-2-yl)-3-methyl-2-{[4-(methylsulfanyl)phenyl]methyl}-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-3-carboxamide |
| Molecular Weight: | 491.65 |
| Molecular Formula: | C28 H33 N3 O3 S |
| Smiles: | CC1(Cn2c(ccc2c2ccco2)C(N1Cc1ccc(cc1)SC)=O)C(NC1CCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2844 |
| logD: | 6.2844 |
| logSw: | -5.3225 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.125 |
| InChI Key: | RVPWVUDNKMVWMT-NDEPHWFRSA-N |