1-(4-benzyl-3-oxo-3,4-dihydropyrido[2,3-b]pyrazin-2-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-(4-benzyl-3-oxo-3,4-dihydropyrido[2,3-b]pyrazin-2-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}piperidine-4-carboxamide
1-(4-benzyl-3-oxo-3,4-dihydropyrido[2,3-b]pyrazin-2-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F674-0112 |
| Compound Name: | 1-(4-benzyl-3-oxo-3,4-dihydropyrido[2,3-b]pyrazin-2-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}piperidine-4-carboxamide |
| Molecular Weight: | 499.63 |
| Molecular Formula: | C28 H29 N5 O2 S |
| Smiles: | CSc1ccc(CNC(C2CCN(CC2)C2C(N(Cc3ccccc3)c3c(cccn3)N=2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7253 |
| logD: | 3.7252 |
| logSw: | -3.8772 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.964 |
| InChI Key: | KPCNXQYFQKTCPZ-UHFFFAOYSA-N |