dimethyl 5-{[3-amino-4-(piperidin-1-yl)benzene-1-sulfonyl]amino}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{[3-amino-4-(piperidin-1-yl)benzene-1-sulfonyl]amino}benzene-1,3-dicarboxylate
dimethyl 5-{[3-amino-4-(piperidin-1-yl)benzene-1-sulfonyl]amino}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | 8011-5567 |
| Compound Name: | dimethyl 5-{[3-amino-4-(piperidin-1-yl)benzene-1-sulfonyl]amino}benzene-1,3-dicarboxylate |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C21 H25 N3 O6 S |
| Smiles: | COC(c1cc(cc(c1)NS(c1ccc(c(c1)N)N1CCCCC1)(=O)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.789 |
| logD: | 3.7376 |
| logSw: | -4.1553 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 106.483 |
| InChI Key: | WSFHDSNUVGSWKD-UHFFFAOYSA-N |