3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(thiophen-2-yl)methyl]benzamide
Chemical Structure Depiction of
3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(thiophen-2-yl)methyl]benzamide
3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(thiophen-2-yl)methyl]benzamide
Compound characteristics
Compound ID: | K288-0503 |
Compound Name: | 3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(thiophen-2-yl)methyl]benzamide |
Molecular Weight: | 427.93 |
Molecular Formula: | C20 H14 Cl N3 O2 S2 |
Smiles: | C(c1cccs1)NC(c1cccc(c1)N1C(c2ccc(cc2NC1=S)[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 3.9489 |
logD: | 3.5716 |
logSw: | -4.4731 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 52.138 |
InChI Key: | WZFZUYMONNREKP-UHFFFAOYSA-N |