3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(4-methoxyphenyl)methyl]benzamide
Chemical Structure Depiction of
3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(4-methoxyphenyl)methyl]benzamide
3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(4-methoxyphenyl)methyl]benzamide
Compound characteristics
| Compound ID: | K288-0660 |
| Compound Name: | 3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(4-methoxyphenyl)methyl]benzamide |
| Molecular Weight: | 451.93 |
| Molecular Formula: | C23 H18 Cl N3 O3 S |
| Smiles: | COc1ccc(CNC(c2cccc(c2)N2C(c3ccc(cc3NC2=S)[Cl])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9562 |
| logD: | 3.5789 |
| logSw: | -4.4824 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.664 |
| InChI Key: | HZZVFUMKUSAWPW-UHFFFAOYSA-N |