3-chloro-N-{[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
Chemical Structure Depiction of
3-chloro-N-{[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
3-chloro-N-{[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
Compound characteristics
Compound ID: | 4028-1633 |
Compound Name: | 3-chloro-N-{[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide |
Molecular Weight: | 408.86 |
Molecular Formula: | C20 H13 Cl N4 O2 S |
Smiles: | c1cc(cc(c1)[Cl])C(NC(Nc1ccc(cc1)c1nc2c(cccn2)o1)=S)=O |
Stereo: | ACHIRAL |
logP: | 4.6447 |
logD: | 4.6399 |
logSw: | -4.939 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 60.424 |
InChI Key: | BIXYNMYPJYWAOJ-UHFFFAOYSA-N |