3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C115-0279 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 563.63 |
| Molecular Formula: | C29 H29 N3 O7 S |
| Smiles: | CN1C(C(C(Nc2nc3ccc(cc3s2)OC)=O)c2cc(c(cc2C1=O)OC)OC)c1ccc(c(c1)OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0426 |
| logD: | 4.0414 |
| logSw: | -4.2962 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.606 |
| InChI Key: | RKPMQCSPUFYIKO-UHFFFAOYSA-N |