2-chloro-3,5-dinitro-N-[4-oxo-2-(thiophen-2-yl)quinazolin-3(4H)-yl]benzamide
Chemical Structure Depiction of
2-chloro-3,5-dinitro-N-[4-oxo-2-(thiophen-2-yl)quinazolin-3(4H)-yl]benzamide
2-chloro-3,5-dinitro-N-[4-oxo-2-(thiophen-2-yl)quinazolin-3(4H)-yl]benzamide
Compound characteristics
Compound ID: | 3279-5175 |
Compound Name: | 2-chloro-3,5-dinitro-N-[4-oxo-2-(thiophen-2-yl)quinazolin-3(4H)-yl]benzamide |
Molecular Weight: | 471.83 |
Molecular Formula: | C19 H10 Cl N5 O6 S |
Smiles: | c1ccc2c(c1)C(N(C(c1cccs1)=N2)NC(c1cc(cc(c1[Cl])[N+]([O-])=O)[N+]([O-])=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.5386 |
logD: | 2.1891 |
logSw: | -3.9832 |
Hydrogen bond acceptors count: | 13 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 119.231 |
InChI Key: | QUKFVAHYZROZHW-UHFFFAOYSA-N |