Karminsure
TL;DR: Karminsure (CAS 1260-35-1) is a chemical compound with molecular formula C22H24ClN5O7 and molecular weight 505.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[3-acetamido-4-[(2-chloro-4-nitrophenyl)diazenyl]-N-(3-methoxy-3-oxopropyl)anilino]propanoate
Also Known As: Karminsure, methyl 3-[3-acetamido-4-[(2-chloro-4-nitrophenyl)diazenyl]-N-(3-methoxy-3-oxopropyl)anilino]propanoate, dimethyl 3,3'-({3-(acetylamino)-4-[(e)-(2-chloro-4-nitrophenyl)diazenyl]phenyl}imino)dipropanoate(non-preferred name), Methyl N-(3-(acetylamino)-4-((2-chloro-4-nitrophenyl)azo)phenyl)-N-(3-methoxy-3-oxopropyl)-beta-alaninate, methyl N-[3-(acetylamino)-4-[(2-chloro-4-nitrophenyl)azo]phenyl]-N-(3-methoxy-3-oxopropyl)-beta-alan
| Molecular Formula | C22H24ClN5O7 |
|---|---|
| Molecular Weight | 505.14 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 505.1364 |
| Heavy Atoms | 35 |
| Complexity | 758.0 |
Chemical Identifiers
| CAS Number | 1260-35-1 |
|---|---|
| SMILES | CC(=O)NC1=C(C=CC(=C1)N(CCC(=O)OC)CCC(=O)OC)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl |
| InChIKey | FLXMHYAPIQKKCZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Karminsure (CAS 1260-35-1), with molecular formula C22H24ClN5O7 and molecular weight 505.14 g/mol. IUPAC: methyl 3-[3-acetamido-4-[(2-chloro-4-nitrophenyl)diazenyl]-N-(3-methoxy-3-oxopropyl)anilino]propanoate.
Chemical Property Profile of Karminsure
Property Insights of Karminsure
The XLogP value of 3.1 indicates that Karminsure is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 155.0 Ų indicates high polarity, suggesting Karminsure may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Karminsure has 1 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 Karminsure?
The CAS number of Karminsure is 1260-35-1.
What is the molecular formula of Karminsure?
The molecular formula of Karminsure is C22H24ClN5O7.
What is the molecular weight of Karminsure?
The molecular weight of Karminsure is 505.14 g/mol.
Where can I buy Karminsure?
You can request a quote for Karminsure directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Karminsure?
Yes, KEHONG BIO provides custom synthesis services for Karminsure and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.