N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | K284-1955 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 582.7 |
| Molecular Formula: | C28 H30 N4 O6 S2 |
| Smiles: | COc1ccc(CCNC(CSC2=Nc3ccccc3C(N2CCc2ccc(cc2)S(N)(=O)=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.5983 |
| logD: | 1.5976 |
| logSw: | -2.6352 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 115.926 |
| InChI Key: | PXAXGXRDLBCQME-UHFFFAOYSA-N |