dimethyl 5-[3-(1-acetyl-1,2,3,4-tetrahydroquinoline-6-sulfonyl)propanamido]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[3-(1-acetyl-1,2,3,4-tetrahydroquinoline-6-sulfonyl)propanamido]benzene-1,3-dicarboxylate
dimethyl 5-[3-(1-acetyl-1,2,3,4-tetrahydroquinoline-6-sulfonyl)propanamido]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C444-0575 |
| Compound Name: | dimethyl 5-[3-(1-acetyl-1,2,3,4-tetrahydroquinoline-6-sulfonyl)propanamido]benzene-1,3-dicarboxylate |
| Molecular Weight: | 502.54 |
| Molecular Formula: | C24 H26 N2 O8 S |
| Smiles: | CC(N1CCCc2cc(ccc12)S(CCC(Nc1cc(cc(c1)C(=O)OC)C(=O)OC)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4071 |
| logD: | 2.4068 |
| logSw: | -2.9633 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 110.552 |
| InChI Key: | KGAIGKHHCIYBGW-UHFFFAOYSA-N |