methyl 2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazoline-7-carboxylate
methyl 2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K284-1374 |
| Compound Name: | methyl 2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 517.62 |
| Molecular Formula: | C24 H27 N3 O6 S2 |
| Smiles: | CC(C)(C)C(CSC1=Nc2cc(ccc2C(N1CCc1ccc(cc1)S(N)(=O)=O)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0449 |
| logD: | 3.0442 |
| logSw: | -3.5284 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 111.045 |
| InChI Key: | GEWLFXRVXNTMAI-UHFFFAOYSA-N |