2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy-
TL;DR: 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy- (CAS 117-46-4) is a chemical compound with molecular formula C17H13NO8S2 and molecular weight 423.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzamido-5-hydroxynaphthalene-2,7-disulfonic acid
Also Known As: H Acid, N-benzoyl-, N-Benzoyl H acid, N-BenzoylH acid, N-Benzoyl H-acid, 4-benzamido-5-hydroxynaphthalene-2,7-disulfonic acid
| Molecular Formula | C17H13NO8S2 |
|---|---|
| Molecular Weight | 423.01 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 423.00827 |
| Heavy Atoms | 28 |
| Complexity | 779.0 |
Chemical Identifiers
| CAS Number | 117-46-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O |
| InChIKey | RKKZDGOUSIOSIY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy- (CAS 117-46-4), with molecular formula C17H13NO8S2 and molecular weight 423.01 g/mol. IUPAC: 4-benzamido-5-hydroxynaphthalene-2,7-disulfonic acid.
Chemical Property Profile of 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy-
Property Insights of 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy-. The TPSA of 175.0 Ų indicates high polarity, suggesting 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy- has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy-?
The CAS number of 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy- is 117-46-4.
What is the molecular formula of 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy-?
The molecular formula of 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy- is C17H13NO8S2.
What is the molecular weight of 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy-?
The molecular weight of 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy- is 423.01 g/mol.
Where can I buy 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy-?
You can request a quote for 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy-?
Yes, KEHONG BIO provides custom synthesis services for 2,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.