3-Gsmab
TL;DR: 3-Gsmab (CAS 71259-45-5) is a chemical compound with molecular formula C23H28N6O6S and molecular weight 516.18 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-[4-[[4-(methylamino)phenyl]diazenyl]phenyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
Also Known As: 3-Gsmab, 3-(Glutathion-S-yl)-N-methyl-4-aminoazobenzene, Glycine, N-(N-L-gamma-glutamyl-S-(4-((4-(methylamino)phenyl)azo)phenyl)-L-cysteinyl)-, (2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[4-[[4-(methylamino)phenyl]diazenyl]phenyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
| Molecular Formula | C23H28N6O6S |
|---|---|
| Molecular Weight | 516.18 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 221.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 14 |
| Exact Mass | 516.1791 |
| Heavy Atoms | 36 |
| Complexity | 768.0 |
Chemical Identifiers
| CAS Number | 71259-45-5 |
|---|---|
| SMILES | CNC1=CC=C(C=C1)N=NC2=CC=C(C=C2)SC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N |
| InChIKey | FGVGDZBENKBMKP-OALUTQOASA-N |
Product Overview
3-Gsmab (CAS 71259-45-5), with molecular formula C23H28N6O6S and molecular weight 516.18 g/mol. IUPAC: (2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[4-[[4-(methylamino)phenyl]diazenyl]phenyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid.
Chemical Property Profile of 3-Gsmab
Property Insights of 3-Gsmab
The XLogP value of -0.8 indicates that 3-Gsmab is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 221.0 Ų indicates high polarity, suggesting 3-Gsmab may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-Gsmab has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Gsmab?
The CAS number of 3-Gsmab is 71259-45-5.
What is the molecular formula of 3-Gsmab?
The molecular formula of 3-Gsmab is C23H28N6O6S.
What is the molecular weight of 3-Gsmab?
The molecular weight of 3-Gsmab is 516.18 g/mol.
Where can I buy 3-Gsmab?
You can request a quote for 3-Gsmab directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Gsmab?
Yes, KEHONG BIO provides custom synthesis services for 3-Gsmab and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.