N-(2-ethylphenyl)-2-(2-methoxyethyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(2-ethylphenyl)-2-(2-methoxyethyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-(2-ethylphenyl)-2-(2-methoxyethyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
Compound ID: | E456-0553 |
Compound Name: | N-(2-ethylphenyl)-2-(2-methoxyethyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
Molecular Weight: | 434.56 |
Molecular Formula: | C25 H26 N2 O3 S |
Smiles: | CCc1ccccc1NC(C1C(c2cccs2)N(CCOC)C(c2ccccc12)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.2969 |
logD: | 4.2968 |
logSw: | -4.1785 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.655 |
InChI Key: | ANFKFZXGBBBQKC-UHFFFAOYSA-N |