EINECS 279-129-1
TL;DR: EINECS 279-129-1 (CAS 79295-92-4) is a chemical compound with molecular formula C21H20ClN7O6 and molecular weight 501.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(2-chloro-4,6-dinitrophenyl)diazenyl]-5-[2-cyanoethyl(prop-2-enyl)amino]-4-methoxyphenyl]acetamide
Also Known As: EINECS 279-129-1, N-[5-[allyl amino]-2-[ azo]-4-methoxyphenyl]acetamide, n-[5-[allyl amino]-2-[azo]-4-methoxyphenyl]acetamide, N-(5-(Allyl(2-cyanoethyl)amino)-2-((2-chloro-4,6-dinitrophenyl)azo)-4-methoxyphenyl)acetamide, N-[5-[ALLYL(2-CYANOETHYL)AMINO]-2-[(2-CHLORO-4,6-DINITROPHENYL)AZO]-4-METHOXYPHENYL]ACETAMIDE
| Molecular Formula | C21H20ClN7O6 |
|---|---|
| Molecular Weight | 501.12 g/mol |
| LogP | 5.44488 |
| Topological Polar Surface Area | 176.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 11 |
| Exact Mass | 501.11636 |
| Heavy Atoms | 35 |
| Complexity | 1241.6447 |
Chemical Identifiers
| CAS Number | 79295-92-4 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])[N+](=O)[O-])OC)N(CCC#N)CC=C |
Product Overview
EINECS 279-129-1 (CAS 79295-92-4), with molecular formula C21H20ClN7O6 and molecular weight 501.12 g/mol. IUPAC: N-[2-[(2-chloro-4,6-dinitrophenyl)diazenyl]-5-[2-cyanoethyl(prop-2-enyl)amino]-4-methoxyphenyl]acetamide.
Chemical Property Profile of EINECS 279-129-1
Property Insights of EINECS 279-129-1
The XLogP value of 5.44488 indicates that EINECS 279-129-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 176.36 Ų indicates high polarity, suggesting EINECS 279-129-1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 279-129-1 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 EINECS 279-129-1?
The CAS number of EINECS 279-129-1 is 79295-92-4.
What is the molecular formula of EINECS 279-129-1?
The molecular formula of EINECS 279-129-1 is C21H20ClN7O6.
What is the molecular weight of EINECS 279-129-1?
The molecular weight of EINECS 279-129-1 is 501.12 g/mol.
Where can I buy EINECS 279-129-1?
You can request a quote for EINECS 279-129-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 279-129-1?
Yes, KEHONG BIO provides custom synthesis services for EINECS 279-129-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.