N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C066-0758 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 536.58 |
| Molecular Formula: | C32 H28 N2 O6 |
| Smiles: | COc1ccc(cc1)C1C(C(Nc2ccc3c(c2)OCCO3)=O)c2ccccc2C(N1c1ccc(cc1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3546 |
| logD: | 4.3481 |
| logSw: | -4.3988 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.042 |
| InChI Key: | UXRLSFGRKRVLLO-UHFFFAOYSA-N |