N-[(4-ethylphenyl)methyl]-2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Chemical Structure Depiction of
N-[(4-ethylphenyl)methyl]-2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
N-[(4-ethylphenyl)methyl]-2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Compound characteristics
| Compound ID: | G791-1095 |
| Compound Name: | N-[(4-ethylphenyl)methyl]-2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C25 H25 F N2 O3 S |
| Smiles: | CCc1ccc(CNC(C2Cc3ccccc3CN2S(c2ccc(cc2)F)(=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8897 |
| logD: | 4.8894 |
| logSw: | -4.5093 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.495 |
| InChI Key: | ZKCBHGUSMMOGAB-DEOSSOPVSA-N |