dimethyl 5-{[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]amino}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]amino}benzene-1,3-dicarboxylate
dimethyl 5-{[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]amino}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C137-2090 |
| Compound Name: | dimethyl 5-{[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]amino}benzene-1,3-dicarboxylate |
| Molecular Weight: | 537.38 |
| Molecular Formula: | C22 H21 Br N2 O7 S |
| Smiles: | COC(c1cc(cc(c1)NS(c1cc2c(CCN2C(C2CC2)=O)cc1[Br])(=O)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1533 |
| logD: | 3.8948 |
| logSw: | -4.2745 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.438 |
| InChI Key: | SXNPHPYYQDIJNS-UHFFFAOYSA-N |