ethyl 4-(2-{[N-(3-{[(furan-2-yl)methyl]sulfanyl}propyl)glycyl]amino}-5-nitrobenzamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{[N-(3-{[(furan-2-yl)methyl]sulfanyl}propyl)glycyl]amino}-5-nitrobenzamido)benzoate
ethyl 4-(2-{[N-(3-{[(furan-2-yl)methyl]sulfanyl}propyl)glycyl]amino}-5-nitrobenzamido)benzoate
Compound characteristics
| Compound ID: | C284-0562 |
| Compound Name: | ethyl 4-(2-{[N-(3-{[(furan-2-yl)methyl]sulfanyl}propyl)glycyl]amino}-5-nitrobenzamido)benzoate |
| Molecular Weight: | 540.59 |
| Molecular Formula: | C26 H28 N4 O7 S |
| Smiles: | CCOC(c1ccc(cc1)NC(c1cc(ccc1NC(CNCCCSCc1ccco1)=O)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6075 |
| logD: | 3.5079 |
| logSw: | -3.9379 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 119.272 |
| InChI Key: | XAEGJUMFDLDPIO-UHFFFAOYSA-N |