SR 42128
TL;DR: SR 42128 (CAS 98092-14-9) is a chemical compound with molecular formula C39H65N5O9 and molecular weight 747.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-4-[[(2S)-1-[[(3S,4S)-4-amino-3-hydroxy-6-methylheptanoyl]-[(2S)-2-[[(2S)-2-(3-methylbutanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-1-oxopropan-2-yl]amino]-3-hydroxy-6-methylheptanoic acid
Also Known As: Iva-phe-nle-sta-ala-sta-OH, ISOVALERYL-PHE-NLE-STA-ALA-STA-OH, SR 42128, Isovaleryl-phenylalanyl-norleucyl-statine-alanyl-hydroxystatine, (3S)-4-[[(2S)-1-[[(3S,4S)-4-amino-3-hydroxy-6-methylheptanoyl]-[(2S)-2-[[(2S)-2-(3-methylbutanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-1-oxopropan-2-yl]amino]-3-hydroxy-6-methylheptanoic acid
| Molecular Formula | C39H65N5O9 |
|---|---|
| Molecular Weight | 747.48 g/mol |
| LogP | 2.6696 |
| Topological Polar Surface Area | 228.46 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 24 |
| Exact Mass | 747.4782 |
| Heavy Atoms | 53 |
| Complexity | 1323.424 |
Chemical Identifiers
| CAS Number | 98092-14-9 |
|---|---|
| SMILES | CCCC[C@@H](C(=O)N(C(=O)C[C@@H]([C@H](CC(C)C)N)O)C(=O)[C@H](C)NC(CC(C)C)[C@H](CC(=O)O)O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CC(C)C |
Product Overview
SR 42128 (CAS 98092-14-9), with molecular formula C39H65N5O9 and molecular weight 747.48 g/mol. IUPAC: (3S)-4-[[(2S)-1-[[(3S,4S)-4-amino-3-hydroxy-6-methylheptanoyl]-[(2S)-2-[[(2S)-2-(3-methylbutanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-1-oxopropan-2-yl]amino]-3-hydroxy-6-methylheptanoic acid.
Chemical Property Profile of SR 42128
Property Insights of SR 42128
The XLogP value of 2.6696 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SR 42128. The TPSA of 228.46 Ų indicates high polarity, suggesting SR 42128 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, SR 42128 has 7 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of SR 42128?
The CAS number of SR 42128 is 98092-14-9.
What is the molecular formula of SR 42128?
The molecular formula of SR 42128 is C39H65N5O9.
What is the molecular weight of SR 42128?
The molecular weight of SR 42128 is 747.48 g/mol.
Where can I buy SR 42128?
You can request a quote for SR 42128 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SR 42128?
Yes, KEHONG BIO provides custom synthesis services for SR 42128 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.