dimethyl 5-[(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)amino]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)amino]benzene-1,3-dicarboxylate
dimethyl 5-[(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)amino]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C069-0785 |
| Compound Name: | dimethyl 5-[(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)amino]benzene-1,3-dicarboxylate |
| Molecular Weight: | 511.35 |
| Molecular Formula: | C20 H19 Br N2 O7 S |
| Smiles: | CC(N1CCc2cc(c(cc12)S(Nc1cc(cc(c1)C(=O)OC)C(=O)OC)(=O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3421 |
| logD: | 3.0836 |
| logSw: | -3.8261 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.654 |
| InChI Key: | XTKQJVIGBXJYTK-UHFFFAOYSA-N |