N-[3-(1,3-benzothiazol-2-yl)phenyl]-3-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]propanamide
Chemical Structure Depiction of
N-[3-(1,3-benzothiazol-2-yl)phenyl]-3-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]propanamide
N-[3-(1,3-benzothiazol-2-yl)phenyl]-3-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]propanamide
Compound characteristics
| Compound ID: | 5867-3896 |
| Compound Name: | N-[3-(1,3-benzothiazol-2-yl)phenyl]-3-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]propanamide |
| Molecular Weight: | 431.54 |
| Molecular Formula: | C22 H17 N5 O S2 |
| Smiles: | C(CSc1nnc2ccccn12)C(Nc1cccc(c1)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3618 |
| logD: | 4.3618 |
| logSw: | -4.4405 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.757 |
| InChI Key: | XBHHFNNXDNJRFF-UHFFFAOYSA-N |