4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene
TL;DR: 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene (CAS 55936-76-0) is a chemical compound with molecular formula C17H17N3O4 and molecular weight 327.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[4-[acetyloxy(methyl)amino]phenyl]diazenyl]benzoate
Also Known As: 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene, p-[[p- phenyl]azo]benzoicacidmethylester, methyl 4-[[4-[acetyloxy(methyl)amino]phenyl]diazenyl]benzoate, Benzoic acid, p-((p-(acetoxymethylamino)phenyl)azo)-, methyl ester, Benzoic acid, 4-((4-((acetyloxy)methylamino)phenyl)azo)-, methyl ester
| Molecular Formula | C17H17N3O4 |
|---|---|
| Molecular Weight | 327.12 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 80.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 327.12192 |
| Heavy Atoms | 24 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 55936-76-0 |
|---|---|
| SMILES | CC(=O)ON(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)OC |
| InChIKey | XLRYBCRFFFGIBX-UHFFFAOYSA-N |
Product Overview
4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene (CAS 55936-76-0), with molecular formula C17H17N3O4 and molecular weight 327.12 g/mol. IUPAC: methyl 4-[[4-[acetyloxy(methyl)amino]phenyl]diazenyl]benzoate.
Chemical Property Profile of 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene
Property Insights of 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene
The XLogP value of 3.8 indicates that 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene. Following Lipinski's Rule of Five, 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene has 0 hydrogen bond donor(s) and 7 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 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene?
The CAS number of 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene is 55936-76-0.
What is the molecular formula of 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene?
The molecular formula of 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene is C17H17N3O4.
What is the molecular weight of 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene?
The molecular weight of 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene is 327.12 g/mol.
Where can I buy 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene?
You can request a quote for 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene?
Yes, KEHONG BIO provides custom synthesis services for 4'-Methoxycarbonyl-N-acetoxy-N-methyl-4-aminoazobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.