1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate
TL;DR: 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate (CAS 114811-36-8) is a chemical compound with molecular formula C17H27N7O8S and molecular weight 489.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[[1-[2-(2-hydroxyethylamino)-2-oxoethyl]imidazol-2-yl]amino]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
Also Known As: Rnhoh-gsh conjugate, (2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[[1-[2-(2-hydroxyethylamino)-2-oxoethyl]imidazol-2-yl]amino]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid, 1-N-(2-Hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate, 5-[(1-[(Carboxymethyl)imino]-1-hydroxy-3-{[(1-{2-hydroxy-2-[(2-hydroxyethyl)imino]ethyl}-1H-imidazol-2-yl)amino]sulfanyl}propan-2-yl)imino]-5-hydroxynorvaline, 5-{[(2R)-1-[(Carboxymethyl)imino]-1-hydroxy-3-{[(1-{2-hydroxy-2-[(2-hydroxyethyl)imino]ethyl}-1H-imidazol-2-yl)amino]sulfanyl}propan-2-yl]imino}-5-hydroxy-L-norvaline
| Molecular Formula | C17H27N7O8S |
|---|---|
| Molecular Weight | 489.16 g/mol |
| LogP | -4.9 |
| Topological Polar Surface Area | 263.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 16 |
| Exact Mass | 489.16418 |
| Heavy Atoms | 33 |
| Complexity | 698.0 |
Chemical Identifiers
| CAS Number | 114811-36-8 |
|---|---|
| SMILES | C1=CN(C(=N1)NSC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)CC(=O)NCCO |
| InChIKey | LOIIXYIFONJUMW-QWRGUYRKSA-N |
Product Overview
1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate (CAS 114811-36-8), with molecular formula C17H27N7O8S and molecular weight 489.16 g/mol. IUPAC: (2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[[1-[2-(2-hydroxyethylamino)-2-oxoethyl]imidazol-2-yl]amino]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid.
Chemical Property Profile of 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate
Property Insights of 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate
The XLogP value of -4.9 indicates that 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 263.0 Ų indicates high polarity, suggesting 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate has 8 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate?
The CAS number of 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate is 114811-36-8.
What is the molecular formula of 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate?
The molecular formula of 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate is C17H27N7O8S.
What is the molecular weight of 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate?
The molecular weight of 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate is 489.16 g/mol.
Where can I buy 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate?
You can request a quote for 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate?
Yes, KEHONG BIO provides custom synthesis services for 1-N-(2-hydroxyethyl)acetamido-2-hydroxylaminoimidazole-glutathione conjugate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.