ethyl 4-{[(2-chlorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}butanoate
Chemical Structure Depiction of
ethyl 4-{[(2-chlorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}butanoate
ethyl 4-{[(2-chlorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}butanoate
Compound characteristics
| Compound ID: | K783-3348 |
| Compound Name: | ethyl 4-{[(2-chlorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}butanoate |
| Molecular Weight: | 440.9 |
| Molecular Formula: | C19 H21 Cl N2 O6 S |
| Smiles: | CCOC(CCCN(Cc1ccccc1[Cl])S(c1ccc(cc1)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9282 |
| logD: | 3.9282 |
| logSw: | -4.1692 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 85.132 |
| InChI Key: | IQMVEUXKIFRVEW-UHFFFAOYSA-N |