3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(2-chlorophenyl)methyl]benzamide
Chemical Structure Depiction of
3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(2-chlorophenyl)methyl]benzamide
3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(2-chlorophenyl)methyl]benzamide
Compound characteristics
Compound ID: | K288-0690 |
Compound Name: | 3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(2-chlorophenyl)methyl]benzamide |
Molecular Weight: | 456.35 |
Molecular Formula: | C22 H15 Cl2 N3 O2 S |
Smiles: | C(c1ccccc1[Cl])NC(c1cccc(c1)N1C(c2ccc(cc2NC1=S)[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 4.7558 |
logD: | 4.3786 |
logSw: | -4.934 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 51.12 |
InChI Key: | NZIQIKMDTOALBR-UHFFFAOYSA-N |