N-[(4-ethoxyphenyl)methyl]-2-(3-methylbenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Chemical Structure Depiction of
N-[(4-ethoxyphenyl)methyl]-2-(3-methylbenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
N-[(4-ethoxyphenyl)methyl]-2-(3-methylbenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Compound characteristics
| Compound ID: | G791-1364 |
| Compound Name: | N-[(4-ethoxyphenyl)methyl]-2-(3-methylbenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
| Molecular Weight: | 464.58 |
| Molecular Formula: | C26 H28 N2 O4 S |
| Smiles: | CCOc1ccc(CNC(C2Cc3ccccc3CN2S(c2cccc(C)c2)(=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7238 |
| logD: | 4.7237 |
| logSw: | -4.4283 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.619 |
| InChI Key: | XKYBZCNMOYHVGH-VWLOTQADSA-N |