Ammonium rhodanilate
TL;DR: Ammonium rhodanilate (CAS 10380-20-8) is a chemical compound with molecular formula C16H18CrN7S4 and molecular weight 487.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azanium;aniline;chromium(3+);tetrathiocyanate
Also Known As: Ammonium rhodanilate, Rhodanilic acid, ammonium salt, azanium;aniline;chromium(3+);tetrathiocyanate, Ammonium tetraisothiocyanatobis(aniline)chromate(III), azanium; aniline; chromium(3+); tetrathiocyanate
| Molecular Formula | C16H18CrN7S4 |
|---|---|
| Molecular Weight | 487.99 g/mol |
| LogP | 2.97 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 0 |
| Exact Mass | 487.99115 |
| Heavy Atoms | 28 |
| Complexity | 77.0 |
Chemical Identifiers
| CAS Number | 10380-20-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)N.C1=CC=C(C=C1)N.C(#N)[S-].C(#N)[S-].C(#N)[S-].C(#N)[S-].[NH4+].[Cr+3] |
| InChIKey | JHUMLPKPKQLKBG-UHFFFAOYSA-K |
Product Overview
Ammonium rhodanilate (CAS 10380-20-8), with molecular formula C16H18CrN7S4 and molecular weight 487.99 g/mol. IUPAC: azanium;aniline;chromium(3+);tetrathiocyanate.
Chemical Property Profile of Ammonium rhodanilate
Property Insights of Ammonium rhodanilate
The XLogP value of 2.97 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium rhodanilate. The TPSA of 152.0 Ų indicates high polarity, suggesting Ammonium rhodanilate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ammonium rhodanilate has 3 hydrogen bond donor(s) and 10 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 Ammonium rhodanilate?
The CAS number of Ammonium rhodanilate is 10380-20-8.
What is the molecular formula of Ammonium rhodanilate?
The molecular formula of Ammonium rhodanilate is C16H18CrN7S4.
What is the molecular weight of Ammonium rhodanilate?
The molecular weight of Ammonium rhodanilate is 487.99 g/mol.
Where can I buy Ammonium rhodanilate?
You can request a quote for Ammonium rhodanilate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium rhodanilate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium rhodanilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.