RefChem:446468
TL;DR: RefChem:446468 (CAS 23422-33-5) is a chemical compound with molecular formula C23H25BrN6O12 and molecular weight 656.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-acetamido-4-[(2-bromo-4,6-dinitrophenyl)diazenyl]-2-methoxy-N-(2-methoxycarbonyloxyethyl)anilino]ethyl methyl carbonate
Also Known As: 2,4,10-Trioxa-7-azaundecan-11-oic acid, 7-[5-(acetylamino)-4-[(2-bromo-4,6-dinitrophenyl)azo]-2-methoxyphenyl]-3-oxo-, methyl ester, ((5-(Acetylamino)-4-((2-bromo-4,6-dinitrophenyl)azo)-2-methoxyphenyl)imino)di-2,1-ethanediyl carbonic acid dimethyl ester, ({5-(acetylamino)-4-[(e)-(2-bromo-4,6-dinitrophenyl)diazenyl]-2-methoxyphenyl}imino)diethane-2,1-diyl dimethyl biscarbonate, 2,4,10-Trioxa-7-azaundecan-11-oic acid, 7-(5-(acetylamino)-4-((2-bromo-4,6-dinitrophenyl)azo)-2-methoxyphenyl)-3-oxo-, methyl ester, 2,8,10-Trioxa-5-azaundecanoic acid, 5-(5-(acetylamino)-4-(2-(2-bromo-4,6-dinitrophenyl)diazenyl)-2-methoxyphenyl)-9-oxo-, methyl ester
| Molecular Formula | C23H25BrN6O12 |
|---|---|
| Molecular Weight | 656.07 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 229.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 15 |
| Exact Mass | 656.07135 |
| Heavy Atoms | 42 |
| Complexity | 957.0 |
Chemical Identifiers
| CAS Number | 23422-33-5 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)N(CCOC(=O)OC)CCOC(=O)OC |
| InChIKey | CVESYTJURSOGNA-UHFFFAOYSA-N |
Product Overview
RefChem:446468 (CAS 23422-33-5), with molecular formula C23H25BrN6O12 and molecular weight 656.07 g/mol. IUPAC: 2-[5-acetamido-4-[(2-bromo-4,6-dinitrophenyl)diazenyl]-2-methoxy-N-(2-methoxycarbonyloxyethyl)anilino]ethyl methyl carbonate.
Chemical Property Profile of RefChem:446468
Property Insights of RefChem:446468
The XLogP value of 3.9 indicates that RefChem:446468 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 229.0 Ų indicates high polarity, suggesting RefChem:446468 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:446468 has 1 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:446468?
The CAS number of RefChem:446468 is 23422-33-5.
What is the molecular formula of RefChem:446468?
The molecular formula of RefChem:446468 is C23H25BrN6O12.
What is the molecular weight of RefChem:446468?
The molecular weight of RefChem:446468 is 656.07 g/mol.
Where can I buy RefChem:446468?
You can request a quote for RefChem:446468 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:446468?
Yes, KEHONG BIO provides custom synthesis services for RefChem:446468 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.