methyl 4-oxo-3-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-{[2-(4-sulfamoylphenyl)ethyl]amino}ethyl)sulfanyl]-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 4-oxo-3-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-{[2-(4-sulfamoylphenyl)ethyl]amino}ethyl)sulfanyl]-3,4-dihydroquinazoline-7-carboxylate
methyl 4-oxo-3-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-{[2-(4-sulfamoylphenyl)ethyl]amino}ethyl)sulfanyl]-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K284-2078 |
| Compound Name: | methyl 4-oxo-3-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-{[2-(4-sulfamoylphenyl)ethyl]amino}ethyl)sulfanyl]-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 560.65 |
| Molecular Formula: | C25 H28 N4 O7 S2 |
| Smiles: | COC(c1ccc2C(N(CC3CCCO3)C(=Nc2c1)SCC(NCCc1ccc(cc1)S(N)(=O)=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7164 |
| logD: | 0.7157 |
| logSw: | -2.4048 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 130.515 |
| InChI Key: | DXTMYYXCPRBSGE-GOSISDBHSA-N |