RefChem:446408
TL;DR: RefChem:446408 (CAS 65277-38-5) is a chemical compound with molecular formula C27H22ClN7O11S3 and molecular weight 751.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-chloro-6-(N-methylanilino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(4-methoxy-2-sulfophenyl)diazenyl]naphthalene-2,7-disulfonic acid
Also Known As: 2,7-Naphthalenedisulfonic acid, 5-((4-chloro-6-(methylphenylamino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-methoxy-2-sulfophenyl)azo)-, 2,7-Naphthalenedisulfonic acid, 5-((4-chloro-6-(methylphenylamino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-(2-(4-methoxy-2-sulfophenyl)diazenyl)-, 2,7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-(methylphenylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(4-methoxy-2-sulfophenyl)azo]-, 2,7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-(methylphenylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[2-(4-methoxy-2-sulfophenyl)diazenyl]-, (3E)-5-[[4-chloro-6-(N-methylanilino)-1,3,5-triazin-2-yl]amino]-3-[(4-methoxy-2-sulfophenyl)hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid
| Molecular Formula | C27H22ClN7O11S3 |
|---|---|
| Molecular Weight | 751.02 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 296.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 10 |
| Exact Mass | 751.02277 |
| Heavy Atoms | 49 |
| Complexity | 1490.0 |
Chemical Identifiers
| CAS Number | 65277-38-5 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C2=NC(=NC(=N2)NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(C(=C4O)N=NC5=C(C=C(C=C5)OC)S(=O)(=O)O)S(=O)(=O)O)Cl |
| InChIKey | YAHBNKULQWWRCQ-UHFFFAOYSA-N |
Product Overview
RefChem:446408 (CAS 65277-38-5), with molecular formula C27H22ClN7O11S3 and molecular weight 751.02 g/mol. IUPAC: 5-[[4-chloro-6-(N-methylanilino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(4-methoxy-2-sulfophenyl)diazenyl]naphthalene-2,7-disulfonic acid.
Chemical Property Profile of RefChem:446408
Property Insights of RefChem:446408
The XLogP value of 4.3 indicates that RefChem:446408 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 296.0 Ų indicates high polarity, suggesting RefChem:446408 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:446408 has 5 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:446408?
The CAS number of RefChem:446408 is 65277-38-5.
What is the molecular formula of RefChem:446408?
The molecular formula of RefChem:446408 is C27H22ClN7O11S3.
What is the molecular weight of RefChem:446408?
The molecular weight of RefChem:446408 is 751.02 g/mol.
Where can I buy RefChem:446408?
You can request a quote for RefChem:446408 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:446408?
Yes, KEHONG BIO provides custom synthesis services for RefChem:446408 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.