3-chloro-N-{[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl}-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-{[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl}-1-benzothiophene-2-carboxamide
3-chloro-N-{[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl}-1-benzothiophene-2-carboxamide
Compound characteristics
Compound ID: | D725-0190 |
Compound Name: | 3-chloro-N-{[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl}-1-benzothiophene-2-carboxamide |
Molecular Weight: | 419.89 |
Molecular Formula: | C22 H14 Cl N3 O2 S |
Smiles: | C(c1ccc(cc1)c1nc2c(cccn2)o1)NC(c1c(c2ccccc2s1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 5.0476 |
logD: | 5.0476 |
logSw: | -5.2843 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.583 |
InChI Key: | ZUMVALGCNSUKKJ-UHFFFAOYSA-N |