RefChem:446103
TL;DR: RefChem:446103 (CAS 117-44-2) is a chemical compound with molecular formula C24H21N3O10S3 and molecular weight 607.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-amino-5-methoxy-2-methylphenyl)diazenyl]-5-(benzenesulfonyloxy)naphthalene-2,7-disulfonic acid
Also Known As: 2,7-Naphthalenedisulfonic acid, 4-[(4-amino-5-methoxy-2-methylphenyl)azo]-5-[(phenylsulfonyl)oxy]-, 4-[(4-amino-5-methoxy-2-methylphenyl)diazenyl]-5-(benzenesulfonyloxy)naphthalene-2,7-disulfonic acid, 4-((4-Amino-5-methoxy-o-tolyl)azo)-5-((phenylsulphonyl)oxy)naphthalene-2,7-disulphonic acid, 2,7-Naphthalenedisulfonic acid, 4-((4-amino-5-methoxy-2-methylphenyl)azo)-5-((phenylsulfonyl)oxy)-, 2,7-Naphthalenedisulfonic acid, 4-(2-(4-amino-5-methoxy-2-methylphenyl)diazenyl)-5-((phenylsulfonyl)oxy)-
| Molecular Formula | C24H21N3O10S3 |
|---|---|
| Molecular Weight | 607.04 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 237.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 8 |
| Exact Mass | 607.0389 |
| Heavy Atoms | 40 |
| Complexity | 1220.0 |
Chemical Identifiers
| CAS Number | 117-44-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1N=NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3OS(=O)(=O)C4=CC=CC=C4)S(=O)(=O)O)OC)N |
| InChIKey | QEYCCMMMEKIJFH-UHFFFAOYSA-N |
Product Overview
RefChem:446103 (CAS 117-44-2), with molecular formula C24H21N3O10S3 and molecular weight 607.04 g/mol. IUPAC: 4-[(4-amino-5-methoxy-2-methylphenyl)diazenyl]-5-(benzenesulfonyloxy)naphthalene-2,7-disulfonic acid.
Chemical Property Profile of RefChem:446103
Property Insights of RefChem:446103
The XLogP value of 3.2 indicates that RefChem:446103 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 237.0 Ų indicates high polarity, suggesting RefChem:446103 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:446103 has 3 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:446103?
The CAS number of RefChem:446103 is 117-44-2.
What is the molecular formula of RefChem:446103?
The molecular formula of RefChem:446103 is C24H21N3O10S3.
What is the molecular weight of RefChem:446103?
The molecular weight of RefChem:446103 is 607.04 g/mol.
Where can I buy RefChem:446103?
You can request a quote for RefChem:446103 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:446103?
Yes, KEHONG BIO provides custom synthesis services for RefChem:446103 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.