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 |