ethyl 4-({[2-(morpholin-4-yl)ethyl](4-nitrobenzene-1-sulfonyl)amino}methyl)benzoate
Chemical Structure Depiction of
ethyl 4-({[2-(morpholin-4-yl)ethyl](4-nitrobenzene-1-sulfonyl)amino}methyl)benzoate
ethyl 4-({[2-(morpholin-4-yl)ethyl](4-nitrobenzene-1-sulfonyl)amino}methyl)benzoate
Compound characteristics
| Compound ID: | K783-2054 |
| Compound Name: | ethyl 4-({[2-(morpholin-4-yl)ethyl](4-nitrobenzene-1-sulfonyl)amino}methyl)benzoate |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C22 H27 N3 O7 S |
| Smiles: | CCOC(c1ccc(CN(CCN2CCOCC2)S(c2ccc(cc2)[N+]([O-])=O)(=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1709 |
| logD: | 3.1649 |
| logSw: | -3.4114 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 97.347 |
| InChI Key: | UHNVVRDAIYZQCE-UHFFFAOYSA-N |