methyl 2-[(4-ethoxy-2,4-dioxobutyl)sulfanyl]-4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-[(4-ethoxy-2,4-dioxobutyl)sulfanyl]-4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazoline-7-carboxylate
methyl 2-[(4-ethoxy-2,4-dioxobutyl)sulfanyl]-4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K284-1309 |
| Compound Name: | methyl 2-[(4-ethoxy-2,4-dioxobutyl)sulfanyl]-4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 547.61 |
| Molecular Formula: | C24 H25 N3 O8 S2 |
| Smiles: | CCOC(CC(CSC1=Nc2cc(ccc2C(N1CCc1ccc(cc1)S(N)(=O)=O)=O)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.715 |
| logD: | 1.7143 |
| logSw: | -2.6167 |
| Hydrogen bond acceptors count: | 17 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 130.712 |
| InChI Key: | POQMPKRKACBRMC-UHFFFAOYSA-N |