2-({3-[(4-methylbenzene-1-sulfonyl)amino]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-({3-[(4-methylbenzene-1-sulfonyl)amino]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
2-({3-[(4-methylbenzene-1-sulfonyl)amino]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | K284-4897 |
| Compound Name: | 2-({3-[(4-methylbenzene-1-sulfonyl)amino]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide |
| Molecular Weight: | 587.69 |
| Molecular Formula: | C25 H25 N5 O6 S3 |
| Smiles: | Cc1ccc(cc1)S(NN1C(=Nc2ccccc2C1=O)SCC(NCCc1ccc(cc1)S(N)(=O)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8186 |
| logD: | 0.8179 |
| logSw: | -2.4298 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 142.775 |
| InChI Key: | BQFRXUOEUOOGGP-UHFFFAOYSA-N |