RefChem:189307
TL;DR: RefChem:189307 (CAS 72797-26-3) is a chemical compound with molecular formula C18H19ClN4S and molecular weight 358.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-N-methyl-4-[(3-methyl-1,3-thiazol-3-ium-2-yl)diazenyl]aniline chloride
Also Known As: Thiazolium, 2-((4-(N-methylbenzenemethamine)phenyl)azo)-3-methyl-, chloride, 2-[[4-[BENZYLMETHYLAMINO]PHENYL]AZO]-3-METHYLTHIAZOLIUM CHLORIDE, Thiazolium, 3-methyl-2-(2-(4-(methyl(phenylmethyl)amino)phenyl)diazenyl)-, chloride (1:1), Thiazolium, 3-methyl-2-((4-(methyl(phenylmethyl)amino)phenyl)azo)-, chloride, Thiazolium, 3-methyl-2-[[4-[methyl(phenylmethyl)amino]phenyl]azo]-, chloride
| Molecular Formula | C18H19ClN4S |
|---|---|
| Molecular Weight | 358.10 g/mol |
| LogP | 1.6284 |
| Topological Polar Surface Area | 60.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 358.1019 |
| Heavy Atoms | 24 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 72797-26-3 |
|---|---|
| SMILES | C[N+]1=C(SC=C1)N=NC2=CC=C(C=C2)N(C)CC3=CC=CC=C3.[Cl-] |
| InChIKey | AYTFBSHAPXBMGO-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:189307 (CAS 72797-26-3), with molecular formula C18H19ClN4S and molecular weight 358.10 g/mol. IUPAC: N-benzyl-N-methyl-4-[(3-methyl-1,3-thiazol-3-ium-2-yl)diazenyl]aniline chloride.
Chemical Property Profile of RefChem:189307
Property Insights of RefChem:189307
The XLogP value of 1.6284 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:189307. The TPSA of 60.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:189307. Following Lipinski's Rule of Five, RefChem:189307 has 0 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 RefChem:189307?
The CAS number of RefChem:189307 is 72797-26-3.
What is the molecular formula of RefChem:189307?
The molecular formula of RefChem:189307 is C18H19ClN4S.
What is the molecular weight of RefChem:189307?
The molecular weight of RefChem:189307 is 358.10 g/mol.
Where can I buy RefChem:189307?
You can request a quote for RefChem:189307 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:189307?
Yes, KEHONG BIO provides custom synthesis services for RefChem:189307 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.