EINECS 244-874-3
TL;DR: EINECS 244-874-3 (CAS 22254-53-1) is a chemical compound with molecular formula C19H19ClN4O7 and molecular weight 450.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chloro-2,5-dimethoxyphenyl)-2-[(2-methoxy-4-nitrophenyl)diazenyl]-3-oxobutanamide
Also Known As: N-(4-Chloro-2,5-dimethoxyphenyl)-2-((2-methoxy-4-nitrophenyl)azo)-3-oxobutyramide, N-(4-chloro-2,5-dimethoxyphenyl)-2-[(2-methoxy-4-nitrophenyl)diazenyl]-3-oxobutanamide, n-(4-chloro-2,5-dimethoxyphenyl)-2-[(e)-(2-methoxy-4-nitrophenyl)diazenyl]-3-oxobutanamide, N-(4-Chloro-2,5-dimethoxyphenyl)-2-[(2-methoxy-4-nitrophenyl)azo]-3-oxobutanamide, N-(4-chloro-2,5-dimethoxyphenyl)-2-[(2-methoxy-4-nitrophenyl)azo]-3-oxobutyramide
| Molecular Formula | C19H19ClN4O7 |
|---|---|
| Molecular Weight | 450.09 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 450.09424 |
| Heavy Atoms | 31 |
| Complexity | 674.0 |
Chemical Identifiers
| CAS Number | 22254-53-1 |
|---|---|
| SMILES | CC(=O)C(C(=O)NC1=CC(=C(C=C1OC)Cl)OC)N=NC2=C(C=C(C=C2)[N+](=O)[O-])OC |
| InChIKey | UKDQJSCBLDOTIF-UHFFFAOYSA-N |
Product Overview
EINECS 244-874-3 (CAS 22254-53-1), with molecular formula C19H19ClN4O7 and molecular weight 450.09 g/mol. IUPAC: N-(4-chloro-2,5-dimethoxyphenyl)-2-[(2-methoxy-4-nitrophenyl)diazenyl]-3-oxobutanamide.
Chemical Property Profile of EINECS 244-874-3
Property Insights of EINECS 244-874-3
The XLogP value of 3.9 indicates that EINECS 244-874-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.0 Ų indicates high polarity, suggesting EINECS 244-874-3 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 244-874-3 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 244-874-3?
The CAS number of EINECS 244-874-3 is 22254-53-1.
What is the molecular formula of EINECS 244-874-3?
The molecular formula of EINECS 244-874-3 is C19H19ClN4O7.
What is the molecular weight of EINECS 244-874-3?
The molecular weight of EINECS 244-874-3 is 450.09 g/mol.
Where can I buy EINECS 244-874-3?
You can request a quote for EINECS 244-874-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 244-874-3?
Yes, KEHONG BIO provides custom synthesis services for EINECS 244-874-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.