(3-[(4-ethylphenyl)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-[(4-ethylphenyl)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-[(4-ethylphenyl)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: | K227-0318 |
| Compound Name: | (3-[(4-ethylphenyl)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: | 602.71 |
| Molecular Formula: | C35 H30 N4 O4 S |
| Smiles: | CCc1ccc(cc1)NC(C1=Cc2c(COC(C)=O)cnc(C)c2OC/1=N/c1ccc(cc1)c1nc2ccc(C)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0594 |
| logD: | 7.0593 |
| logSw: | -5.4077 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.115 |
| InChI Key: | XOIGHNBVUIVRJH-UHFFFAOYSA-N |