3-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(3,4,5-trimethoxyphenyl)propanamide
Chemical Structure Depiction of
3-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(3,4,5-trimethoxyphenyl)propanamide
3-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(3,4,5-trimethoxyphenyl)propanamide
Compound characteristics
| Compound ID: | K288-0425 |
| Compound Name: | 3-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(3,4,5-trimethoxyphenyl)propanamide |
| Molecular Weight: | 415.47 |
| Molecular Formula: | C20 H21 N3 O5 S |
| Smiles: | COc1cc(cc(c1OC)OC)NC(CCN1C(c2ccccc2NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2822 |
| logD: | 2.2808 |
| logSw: | -3.1858 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.424 |
| InChI Key: | VNSFDHJGNCVNCC-UHFFFAOYSA-N |