N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-2259 |
| Compound Name: | N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 471.53 |
| Molecular Formula: | C26 H21 N3 O4 S |
| Smiles: | CCOc1ccc2c(c1)sc(NC(C1=CN(C(c3ccccc13)=O)c1cccc(c1)OC)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.0347 |
| logD: | 5.0328 |
| logSw: | -4.691 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.274 |
| InChI Key: | UPVGWWMCULIQRR-UHFFFAOYSA-N |