dimethyl 5-[(4-chloro-3-{[(2-hydroxynaphthalen-1-yl)methylidene]amino}benzene-1-sulfonyl)amino]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[(4-chloro-3-{[(2-hydroxynaphthalen-1-yl)methylidene]amino}benzene-1-sulfonyl)amino]benzene-1,3-dicarboxylate
dimethyl 5-[(4-chloro-3-{[(2-hydroxynaphthalen-1-yl)methylidene]amino}benzene-1-sulfonyl)amino]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | 8005-8693 |
| Compound Name: | dimethyl 5-[(4-chloro-3-{[(2-hydroxynaphthalen-1-yl)methylidene]amino}benzene-1-sulfonyl)amino]benzene-1,3-dicarboxylate |
| Molecular Weight: | 552.99 |
| Molecular Formula: | C27 H21 Cl N2 O7 S |
| Smiles: | COC(c1cc(cc(c1)NS(c1ccc(c(c1)/N=C/c1c(ccc2ccccc12)O)[Cl])(=O)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9513 |
| logD: | 5.5645 |
| logSw: | -5.9498 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.942 |
| InChI Key: | BPYSVOPMUMPLQY-UHFFFAOYSA-N |