Methyl nicotinium p-toluene sulfonate hydrazide
TL;DR: Methyl nicotinium p-toluene sulfonate hydrazide (CAS 5406-79-1) is a chemical compound with molecular formula C14H17N3O4S and molecular weight 323.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylbenzenesulfonate;1-methylpyridin-1-ium-3-carbohydrazide
Also Known As: Methyl nicotinium p-toluene sulfonate hydrazide, 4-methylbenzenesulfonic acid; 1-methylpyridine-5-carbohydrazide, N-methyl-beta-carbohydrazidopyridinium-p-toluene sulfonate, 4-methylbenzenesulfonate,1-methylpyridin-1-ium-3-carbohydraz, 3-(Hydrazinocarbonyl)-1-methylpyridinium 4-methylbenzenesulfonate
| Molecular Formula | C14H17N3O4S |
|---|---|
| Molecular Weight | 323.09 g/mol |
| LogP | 0.01372 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 323.09396 |
| Heavy Atoms | 22 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 5406-79-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC(=C1)C(=O)NN |
| InChIKey | QVMQPBSIOKAITO-UHFFFAOYSA-N |
Product Overview
Methyl nicotinium p-toluene sulfonate hydrazide (CAS 5406-79-1), with molecular formula C14H17N3O4S and molecular weight 323.09 g/mol. IUPAC: 4-methylbenzenesulfonate;1-methylpyridin-1-ium-3-carbohydrazide.
Chemical Property Profile of Methyl nicotinium p-toluene sulfonate hydrazide
Property Insights of Methyl nicotinium p-toluene sulfonate hydrazide
The XLogP value of 0.01372 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl nicotinium p-toluene sulfonate hydrazide. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl nicotinium p-toluene sulfonate hydrazide. Following Lipinski's Rule of Five, Methyl nicotinium p-toluene sulfonate hydrazide has 2 hydrogen bond donor(s) and 5 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 Methyl nicotinium p-toluene sulfonate hydrazide?
The CAS number of Methyl nicotinium p-toluene sulfonate hydrazide is 5406-79-1.
What is the molecular formula of Methyl nicotinium p-toluene sulfonate hydrazide?
The molecular formula of Methyl nicotinium p-toluene sulfonate hydrazide is C14H17N3O4S.
What is the molecular weight of Methyl nicotinium p-toluene sulfonate hydrazide?
The molecular weight of Methyl nicotinium p-toluene sulfonate hydrazide is 323.09 g/mol.
Where can I buy Methyl nicotinium p-toluene sulfonate hydrazide?
You can request a quote for Methyl nicotinium p-toluene sulfonate hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl nicotinium p-toluene sulfonate hydrazide?
Yes, KEHONG BIO provides custom synthesis services for Methyl nicotinium p-toluene sulfonate hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.