3-chloro-N-{[4-chloro-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
Chemical Structure Depiction of
3-chloro-N-{[4-chloro-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
3-chloro-N-{[4-chloro-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
Compound characteristics
Compound ID: | 4028-1587 |
Compound Name: | 3-chloro-N-{[4-chloro-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide |
Molecular Weight: | 443.31 |
Molecular Formula: | C20 H12 Cl2 N4 O2 S |
Smiles: | c1cc(cc(c1)[Cl])C(NC(Nc1ccc(c(c1)c1nc2c(cccn2)o1)[Cl])=S)=O |
Stereo: | ACHIRAL |
logP: | 5.3731 |
logD: | 5.3691 |
logSw: | -5.9446 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 60.424 |
InChI Key: | CPECPBYKIRLAJZ-UHFFFAOYSA-N |