N-{[4-(methylsulfanyl)phenyl]methyl}-1-(6-phenyl-5,6-dihydro-8H-imidazo[5,1-c][1,4]oxazine-1-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-{[4-(methylsulfanyl)phenyl]methyl}-1-(6-phenyl-5,6-dihydro-8H-imidazo[5,1-c][1,4]oxazine-1-carbonyl)piperidine-4-carboxamide
N-{[4-(methylsulfanyl)phenyl]methyl}-1-(6-phenyl-5,6-dihydro-8H-imidazo[5,1-c][1,4]oxazine-1-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | S357-0028 |
| Compound Name: | N-{[4-(methylsulfanyl)phenyl]methyl}-1-(6-phenyl-5,6-dihydro-8H-imidazo[5,1-c][1,4]oxazine-1-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 490.62 |
| Molecular Formula: | C27 H30 N4 O3 S |
| Smiles: | CSc1ccc(CNC(C2CCN(CC2)C(c2c3COC(Cn3cn2)c2ccccc2)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4698 |
| logD: | 2.4698 |
| logSw: | -2.6058 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.983 |
| InChI Key: | XNZRWSPBMIQKJN-XMMPIXPASA-N |