N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzamide
Compound characteristics
Compound ID: | K288-0715 |
Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzamide |
Molecular Weight: | 461.54 |
Molecular Formula: | C25 H23 N3 O4 S |
Smiles: | COc1ccc(CCNC(c2ccc(cc2)N2C(c3ccccc3NC2=S)=O)=O)cc1OC |
Stereo: | ACHIRAL |
logP: | 2.8155 |
logD: | 2.8097 |
logSw: | -3.6077 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 66.222 |
InChI Key: | GMWREIDGFLQKRW-UHFFFAOYSA-N |