2-(2-methoxyethyl)-N-(2-methoxy-5-nitrophenyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(2-methoxyethyl)-N-(2-methoxy-5-nitrophenyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-(2-methoxyethyl)-N-(2-methoxy-5-nitrophenyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-0413 |
| Compound Name: | 2-(2-methoxyethyl)-N-(2-methoxy-5-nitrophenyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 481.53 |
| Molecular Formula: | C24 H23 N3 O6 S |
| Smiles: | COCCN1C(C(C(Nc2cc(ccc2OC)[N+]([O-])=O)=O)c2ccccc2C1=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3889 |
| logD: | 2.9321 |
| logSw: | -3.8179 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.667 |
| InChI Key: | AVNQFKVXFFOREF-UHFFFAOYSA-N |