EINECS 279-085-3
TL;DR: EINECS 279-085-3 (CAS 79135-85-6) is a chemical compound with molecular formula C27H26N4O5S and molecular weight 518.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[5-(dimethylsulfamoyl)-2-methylphenyl]diazenyl]-3-hydroxy-N-(2-methoxyphenyl)naphthalene-2-carboxamide
Also Known As: EINECS 279-085-3, 4-((5-((Dimethylamino)sulphonyl)-2-methylphenyl)azo)-3-hydroxy-N-(2-methoxyphenyl)naphthalene-2-carboxamide, 2-Naphthalenecarboxamide,4-[2-[5-[(dimethylamino)sulfonyl]-2-methylphenyl]diazenyl]-3-hydroxy-N-(2-methoxyphenyl)-, (4Z)-4-[[5-(dimethylsulfamoyl)-2-methylphenyl]hydrazinylidene]-N-(2-methoxyphenyl)-3-oxonaphthalene-2-carboxamide, 4-[[5-[(Dimethylamino)sulfonyl]-2-methylphenyl]azo]-3-hydroxy-N-(2-methoxyphenyl)-2-naphthalenecarboxamide
| Molecular Formula | C27H26N4O5S |
|---|---|
| Molecular Weight | 518.16 g/mol |
| LogP | 5.78042 |
| Topological Polar Surface Area | 120.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 518.1624 |
| Heavy Atoms | 37 |
| Complexity | 1631.6766 |
Chemical Identifiers
| CAS Number | 79135-85-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)NC4=CC=CC=C4OC)O |
Product Overview
EINECS 279-085-3 (CAS 79135-85-6), with molecular formula C27H26N4O5S and molecular weight 518.16 g/mol. IUPAC: 4-[[5-(dimethylsulfamoyl)-2-methylphenyl]diazenyl]-3-hydroxy-N-(2-methoxyphenyl)naphthalene-2-carboxamide.
Chemical Property Profile of EINECS 279-085-3
Property Insights of EINECS 279-085-3
The XLogP value of 5.78042 indicates that EINECS 279-085-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.66 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 279-085-3. Following Lipinski's Rule of Five, EINECS 279-085-3 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 279-085-3?
The CAS number of EINECS 279-085-3 is 79135-85-6.
What is the molecular formula of EINECS 279-085-3?
The molecular formula of EINECS 279-085-3 is C27H26N4O5S.
What is the molecular weight of EINECS 279-085-3?
The molecular weight of EINECS 279-085-3 is 518.16 g/mol.
Where can I buy EINECS 279-085-3?
You can request a quote for EINECS 279-085-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 279-085-3?
Yes, KEHONG BIO provides custom synthesis services for EINECS 279-085-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.