[8-methyl-2-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}-3-(phenylcarbamoyl)-2H-pyrano[2,3-c]pyridin-5-yl]methyl acetate
Chemical Structure Depiction of
[8-methyl-2-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}-3-(phenylcarbamoyl)-2H-pyrano[2,3-c]pyridin-5-yl]methyl acetate
[8-methyl-2-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}-3-(phenylcarbamoyl)-2H-pyrano[2,3-c]pyridin-5-yl]methyl acetate
Compound characteristics
| Compound ID: | K227-0506 |
| Compound Name: | [8-methyl-2-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}-3-(phenylcarbamoyl)-2H-pyrano[2,3-c]pyridin-5-yl]methyl acetate |
| Molecular Weight: | 574.66 |
| Molecular Formula: | C33 H26 N4 O4 S |
| Smiles: | CC(=O)OCc1cnc(C)c2c1C=C(/C(=N/c1ccc(cc1)c1nc3ccc(C)cc3s1)O2)C(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.937 |
| logD: | 5.937 |
| logSw: | -5.3716 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.115 |
| InChI Key: | ZUWBBNIPVVLEJL-UHFFFAOYSA-N |