N-(tert-butoxycarbonyl)-3-[(3-nitropyridin-2-yl)disulfanyl]alanine
Chemical Structure Depiction of
N-(tert-butoxycarbonyl)-3-[(3-nitropyridin-2-yl)disulfanyl]alanine
N-(tert-butoxycarbonyl)-3-[(3-nitropyridin-2-yl)disulfanyl]alanine
Compound characteristics
| Compound ID: | 8004-0338 |
| Compound Name: | N-(tert-butoxycarbonyl)-3-[(3-nitropyridin-2-yl)disulfanyl]alanine |
| Molecular Weight: | 375.42 |
| Molecular Formula: | C13 H17 N3 O6 S2 |
| Smiles: | CC(C)(C)OC(NC(CSSc1c(cccn1)[N+]([O-])=O)C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1963 |
| logD: | -1.8042 |
| logSw: | -2.4779 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.412 |
| InChI Key: | OVTLOLNDKQUMRH-QMMMGPOBSA-N |