RefChem:300175
TL;DR: RefChem:300175 (CAS 68833-98-7) is a chemical compound with molecular formula C24H21N3O14S4 and molecular weight 702.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetamido-4-hydroxy-3-[[8-(2-sulfooxyethylsulfonyl)naphthalen-2-yl]diazenyl]naphthalene-2,7-disulfonic acid
Also Known As: 2,7-Naphthalenedisulfonic acid, 5-(acetylamino)-4-hydroxy-3-[[8-[[2-(sulfooxy)ethyl]sulfonyl]-2-naphthalenyl]azo]-, 2,7-Naphthalenedisulfonic acid, 5-(acetylamino)-4-hydroxy-3-((8-((2-(sulfooxy)ethyl)sulfonyl)-2-naphthalenyl)azo)-, 2,7-Naphthalenedisulfonic acid, 5-(acetylamino)-4-hydroxy-3-(2-(8-((2-(sulfooxy)ethyl)sulfonyl)-2-naphthalenyl)diazenyl)-, 2,7-Naphthalenedisulfonic acid, 5-acetylamino-4-hydroxy-3-((8-((2-sulfooxy)ethyl)sulfonyl)naphth-2-yl)azo)-, (3E)-5-acetamido-4-oxo-3-[[8-(2-sulfooxyethylsulfonyl)naphthalen-2-yl]hydrazinylidene]naphthalene-2,7-disulfonic acid
| Molecular Formula | C24H21N3O14S4 |
|---|---|
| Molecular Weight | 702.99 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 314.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 10 |
| Exact Mass | 702.99066 |
| Heavy Atoms | 45 |
| Complexity | 1540.0 |
Chemical Identifiers
| CAS Number | 68833-98-7 |
|---|---|
| SMILES | CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C(=C2O)N=NC3=CC4=C(C=CC=C4S(=O)(=O)CCOS(=O)(=O)O)C=C3)S(=O)(=O)O |
| InChIKey | VNPIQZGDGCXACQ-UHFFFAOYSA-N |
Product Overview
RefChem:300175 (CAS 68833-98-7), with molecular formula C24H21N3O14S4 and molecular weight 702.99 g/mol. IUPAC: 5-acetamido-4-hydroxy-3-[[8-(2-sulfooxyethylsulfonyl)naphthalen-2-yl]diazenyl]naphthalene-2,7-disulfonic acid.
Chemical Property Profile of RefChem:300175
Property Insights of RefChem:300175
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:300175. The TPSA of 314.0 Ų indicates high polarity, suggesting RefChem:300175 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:300175 has 5 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:300175?
The CAS number of RefChem:300175 is 68833-98-7.
What is the molecular formula of RefChem:300175?
The molecular formula of RefChem:300175 is C24H21N3O14S4.
What is the molecular weight of RefChem:300175?
The molecular weight of RefChem:300175 is 702.99 g/mol.
Where can I buy RefChem:300175?
You can request a quote for RefChem:300175 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:300175?
Yes, KEHONG BIO provides custom synthesis services for RefChem:300175 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.