Oxalyl-(met-onp)2
TL;DR: Oxalyl-(met-onp)2 (CAS 87498-79-1) is a chemical compound with molecular formula C24H27N4O10S2+ and molecular weight 595.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S)-1-carboxy-3-methylsulfanylpropyl]-[2-[[(1S)-1-carboxy-3-methylsulfanylpropyl]amino]-2-oxoacetyl]-bis(4-nitrophenyl)azanium
Also Known As: Oxalyl-(met-onp)2, Oxalylbis(methionyl-4-nitrophenyl ester), [(1S)-1-carboxy-3-methylsulfanylpropyl]-[2-[[(1S)-1-carboxy-3-methylsulfanylpropyl]amino]-2-oxoacetyl]-bis(4-nitrophenyl)azanium, L-Methionine, N,N'-(1,2-dioxo-1,2-ethanediyl)bis-, bis(4-nitrophenyl) ester, N-[(1S)-1-Carboxy-3-(methylsulfanyl)propyl]{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]imino}(hydroxy)-N,N-bis(4-nitrophenyl)ethanamidium
| Molecular Formula | C24H27N4O10S2+ |
|---|---|
| Molecular Weight | 595.12 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 263.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 12 |
| Exact Mass | 595.1169 |
| Heavy Atoms | 40 |
| Complexity | 907.0 |
Chemical Identifiers
| CAS Number | 87498-79-1 |
|---|---|
| SMILES | CSCC[C@@H](C(=O)O)NC(=O)C(=O)[N+](C1=CC=C(C=C1)[N+](=O)[O-])(C2=CC=C(C=C2)[N+](=O)[O-])[C@@H](CCSC)C(=O)O |
| InChIKey | HRPGSTCMTIAKAR-PMACEKPBSA-O |
Product Overview
Oxalyl-(met-onp)2 (CAS 87498-79-1), with molecular formula C24H27N4O10S2+ and molecular weight 595.12 g/mol. IUPAC: [(1S)-1-carboxy-3-methylsulfanylpropyl]-[2-[[(1S)-1-carboxy-3-methylsulfanylpropyl]amino]-2-oxoacetyl]-bis(4-nitrophenyl)azanium.
Chemical Property Profile of Oxalyl-(met-onp)2
Property Insights of Oxalyl-(met-onp)2
The XLogP value of 3.8 indicates that Oxalyl-(met-onp)2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 263.0 Ų indicates high polarity, suggesting Oxalyl-(met-onp)2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Oxalyl-(met-onp)2 has 3 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 Oxalyl-(met-onp)2?
The CAS number of Oxalyl-(met-onp)2 is 87498-79-1.
What is the molecular formula of Oxalyl-(met-onp)2?
The molecular formula of Oxalyl-(met-onp)2 is C24H27N4O10S2+.
What is the molecular weight of Oxalyl-(met-onp)2?
The molecular weight of Oxalyl-(met-onp)2 is 595.12 g/mol.
Where can I buy Oxalyl-(met-onp)2?
You can request a quote for Oxalyl-(met-onp)2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxalyl-(met-onp)2?
Yes, KEHONG BIO provides custom synthesis services for Oxalyl-(met-onp)2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.