3-[2-(3,4-dimethoxyphenyl)ethyl]-7-(morpholine-4-carbonyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyphenyl)ethyl]-7-(morpholine-4-carbonyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-[2-(3,4-dimethoxyphenyl)ethyl]-7-(morpholine-4-carbonyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K284-2414 |
| Compound Name: | 3-[2-(3,4-dimethoxyphenyl)ethyl]-7-(morpholine-4-carbonyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 455.53 |
| Molecular Formula: | C23 H25 N3 O5 S |
| Smiles: | COc1ccc(CCN2C(c3ccc(cc3NC2=S)C(N2CCOCC2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.8645 |
| logD: | 1.863 |
| logSw: | -2.7722 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.114 |
| InChI Key: | IGYSMWKLGOTDAG-UHFFFAOYSA-N |