(3-[(2-fluorophenyl)carbamoyl]-8-methyl-2-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}-2H-pyrano[2,3-c]pyridin-5-yl)methyl acetate
Chemical Structure Depiction of
(3-[(2-fluorophenyl)carbamoyl]-8-methyl-2-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}-2H-pyrano[2,3-c]pyridin-5-yl)methyl acetate
(3-[(2-fluorophenyl)carbamoyl]-8-methyl-2-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}-2H-pyrano[2,3-c]pyridin-5-yl)methyl acetate
Compound characteristics
| Compound ID: | K227-0311 |
| Compound Name: | (3-[(2-fluorophenyl)carbamoyl]-8-methyl-2-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}-2H-pyrano[2,3-c]pyridin-5-yl)methyl acetate |
| Molecular Weight: | 592.65 |
| Molecular Formula: | C33 H25 F N4 O4 S |
| Smiles: | CC(=O)OCc1cnc(C)c2c1C=C(/C(=N/c1ccc(cc1)c1nc3ccc(C)cc3s1)O2)C(Nc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1071 |
| logD: | 6.1058 |
| logSw: | -5.3599 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.417 |
| InChI Key: | TVRSZGDMYISYEE-UHFFFAOYSA-N |