2,4-dimethyl-N-{[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
Chemical Structure Depiction of
2,4-dimethyl-N-{[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
2,4-dimethyl-N-{[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
Compound characteristics
Compound ID: | 6731-1419 |
Compound Name: | 2,4-dimethyl-N-{[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide |
Molecular Weight: | 402.47 |
Molecular Formula: | C22 H18 N4 O2 S |
Smiles: | Cc1ccc(C(NC(Nc2cccc(c2)c2nc3c(cccn3)o2)=S)=O)c(C)c1 |
Stereo: | ACHIRAL |
logP: | 5.0555 |
logD: | 5.0533 |
logSw: | -4.566 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 60.424 |
InChI Key: | SIXASWCFTXSFOB-UHFFFAOYSA-N |