methyl 3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-(4-methylphenyl)thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-(4-methylphenyl)thiophene-2-carboxylate
methyl 3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-(4-methylphenyl)thiophene-2-carboxylate
Compound characteristics
| Compound ID: | G225-0463 |
| Compound Name: | methyl 3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-(4-methylphenyl)thiophene-2-carboxylate |
| Molecular Weight: | 427.54 |
| Molecular Formula: | C22 H21 N O4 S2 |
| Smiles: | Cc1ccc(cc1)c1csc(C(=O)OC)c1S(N1CCc2ccccc2C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0099 |
| logD: | 5.0099 |
| logSw: | -4.6053 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.532 |
| InChI Key: | GNZPQESNCDOUKR-UHFFFAOYSA-N |