靛胭脂
TL;DR: 靛胭脂 (CAS 483-20-5) is a chemical compound with molecular formula C16H10N2O8S2 and molecular weight 421.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
靛胭脂
2-(3-hydroxy-5-sulfo-1H-indol-2-yl)-3-oxoindole-5-sulfonic acid
Also Known As: Saxon blue, Indigotindisulfonate, Indigo carmine, Blue X, INDIGOTINDISULFONIC ACID
| Molecular Formula | C16H10N2O8S2 |
|---|---|
| Molecular Weight | 421.99 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 191.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 421.98785 |
| Heavy Atoms | 28 |
| Complexity | 904.0 |
Chemical Identifiers
| CAS Number | 483-20-5 |
|---|---|
| SMILES | C1=CC2=C(C=C1S(=O)(=O)O)C(=C(N2)C3=NC4=C(C3=O)C=C(C=C4)S(=O)(=O)O)O |
| InChIKey | JMEVHYCNAPFOAB-UHFFFAOYSA-N |
Product Overview
靛胭脂 (CAS 483-20-5), with molecular formula C16H10N2O8S2 and molecular weight 421.99 g/mol. IUPAC: 2-(3-hydroxy-5-sulfo-1H-indol-2-yl)-3-oxoindole-5-sulfonic acid.
Chemical Property Profile of 靛胭脂
Property Insights of 靛胭脂
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 靛胭脂. The TPSA of 191.0 Ų indicates high polarity, suggesting 靛胭脂 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Indigotindisulfonic acid has 4 hydrogen bond donor(s) and 9 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 Indigotindisulfonic acid?
The CAS number of Indigotindisulfonic acid is 483-20-5.
What is the molecular formula of Indigotindisulfonic acid?
The molecular formula of Indigotindisulfonic acid is C16H10N2O8S2.
What is the molecular weight of Indigotindisulfonic acid?
The molecular weight of Indigotindisulfonic acid is 421.99 g/mol.
Where can I buy Indigotindisulfonic acid?
You can request a quote for Indigotindisulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indigotindisulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for Indigotindisulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.