2-({6,7-dimethoxy-4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-(4-ethylphenyl)butanamide
Chemical Structure Depiction of
2-({6,7-dimethoxy-4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-(4-ethylphenyl)butanamide
2-({6,7-dimethoxy-4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-(4-ethylphenyl)butanamide
Compound characteristics
| Compound ID: | K284-6000 |
| Compound Name: | 2-({6,7-dimethoxy-4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-(4-ethylphenyl)butanamide |
| Molecular Weight: | 610.75 |
| Molecular Formula: | C30 H34 N4 O6 S2 |
| Smiles: | CCC(C(Nc1ccc(CC)cc1)=O)SC1=Nc2cc(c(cc2C(N1CCc1ccc(cc1)S(N)(=O)=O)=O)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8218 |
| logD: | 4.8211 |
| logSw: | -4.548 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.976 |
| InChI Key: | UGHOAKMDIJQJFM-MHZLTWQESA-N |