N-[(oxolan-2-yl)methyl]-4-{[4-oxo-2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)quinazolin-3(4H)-yl]methyl}cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-[(oxolan-2-yl)methyl]-4-{[4-oxo-2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)quinazolin-3(4H)-yl]methyl}cyclohexane-1-carboxamide
N-[(oxolan-2-yl)methyl]-4-{[4-oxo-2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)quinazolin-3(4H)-yl]methyl}cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | K284-4737 |
| Compound Name: | N-[(oxolan-2-yl)methyl]-4-{[4-oxo-2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)quinazolin-3(4H)-yl]methyl}cyclohexane-1-carboxamide |
| Molecular Weight: | 541.69 |
| Molecular Formula: | C26 H31 N5 O4 S2 |
| Smiles: | C1CC(CNC(C2CCC(CC2)CN2C(=Nc3ccccc3C2=O)SCC(Nc2nccs2)=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9623 |
| logD: | 2.962 |
| logSw: | -3.6899 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.659 |
| InChI Key: | HEPYFJKCLWPUNL-CTWPCTMYSA-N |