RefChem:95745
TL;DR: RefChem:95745 (CAS 68134-35-0) is a chemical compound with molecular formula C20H24ClN3 and molecular weight 341.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-[1-(1,3,3-trimethylindol-1-ium-2-yl)ethylideneamino]aniline chloride
Also Known As: 1,3,3-trimethyl-2-[1- ethyl]-3H-indoliumchloride, 3H-Indolium, 1,3,3-trimethyl-2-[1-(methylphenylhydrazono)ethyl]-, chloride, 1,3,3-Trimethyl-2-(1-(N-methyl-N-phenylhydrazono)ethyl)indolium chloride, 3H-Indolium, 1,3,3-trimethyl-2-(1-(methylphenylhydrazono)ethyl)-, chloride, 1,3,3-trimethyl-2-[1-(methylphenylhydrazono)ethyl]-3H-indolium chloride
| Molecular Formula | C20H24ClN3 |
|---|---|
| Molecular Weight | 341.17 g/mol |
| LogP | 1.21 |
| Topological Polar Surface Area | 18.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.16586 |
| Heavy Atoms | 24 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 68134-35-0 |
|---|---|
| SMILES | CC(=NN(C)C1=CC=CC=C1)C2=[N+](C3=CC=CC=C3C2(C)C)C.[Cl-] |
| InChIKey | GBJJMSLCFBLYHV-UHFFFAOYSA-M |
Product Overview
RefChem:95745 (CAS 68134-35-0), with molecular formula C20H24ClN3 and molecular weight 341.17 g/mol. IUPAC: N-methyl-N-[1-(1,3,3-trimethylindol-1-ium-2-yl)ethylideneamino]aniline chloride.
Chemical Property Profile of RefChem:95745
Property Insights of RefChem:95745
The XLogP value of 1.21 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:95745. With a topological polar surface area (TPSA) of 18.6 Ų, RefChem:95745 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:95745 has 0 hydrogen bond donor(s) and 3 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:95745?
The CAS number of RefChem:95745 is 68134-35-0.
What is the molecular formula of RefChem:95745?
The molecular formula of RefChem:95745 is C20H24ClN3.
What is the molecular weight of RefChem:95745?
The molecular weight of RefChem:95745 is 341.17 g/mol.
Where can I buy RefChem:95745?
You can request a quote for RefChem:95745 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:95745?
Yes, KEHONG BIO provides custom synthesis services for RefChem:95745 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.