N-(1,3-benzothiazol-2-yl)-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(1,3-benzothiazol-2-yl)-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-(1,3-benzothiazol-2-yl)-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C066-0750 |
| Compound Name: | N-(1,3-benzothiazol-2-yl)-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 535.62 |
| Molecular Formula: | C31 H25 N3 O4 S |
| Smiles: | COc1ccc(cc1)C1C(C(Nc2nc3ccccc3s2)=O)c2ccccc2C(N1c1ccc(cc1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.3301 |
| logD: | 6.3222 |
| logSw: | -5.6533 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.98 |
| InChI Key: | BQEGVUIQRBNVKU-UHFFFAOYSA-N |