RefChem:95744
TL;DR: RefChem:95744 (CAS 65121-73-5) is a chemical compound with molecular formula C19H23N3O4S and molecular weight 389.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hydrogen sulfate;N-methyl-N-[(1,3,3-trimethylindol-1-ium-2-yl)methylideneamino]aniline
Also Known As: 1,3,3-Trimethyl-2-((methylphenylhydrazono)methyl)-3H-indolium hydrogen sulphate, 3H-Indolium, 1,3,3-trimethyl-2-[(methylphenylhydrazono)methyl]-, sulfate (1:1), 3H-Indolium, 1,3,3-trimethyl-2-((2-methyl-2-phenylhydrazinylidene)methyl)-, sulfate (1:1), 3H-Indolium, 1,3,3-trimethyl-2-((methylphenylhydrazono)methyl)-, sulfate (1:1), Diazenium, 1-methyl-1-phenyl-2-((1,3,3-trimethyl-2-indolinylidene)methyl)-, hydrogen sulfate
| Molecular Formula | C19H23N3O4S |
|---|---|
| Molecular Weight | 389.14 g/mol |
| LogP | 2.82 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 389.14093 |
| Heavy Atoms | 27 |
| Complexity | 533.0 |
Chemical Identifiers
| CAS Number | 65121-73-5 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2[N+](=C1C=NN(C)C3=CC=CC=C3)C)C.OS(=O)(=O)[O-] |
| InChIKey | TVVVIPKPEFHAOO-UHFFFAOYSA-M |
Product Overview
RefChem:95744 (CAS 65121-73-5), with molecular formula C19H23N3O4S and molecular weight 389.14 g/mol. IUPAC: hydrogen sulfate;N-methyl-N-[(1,3,3-trimethylindol-1-ium-2-yl)methylideneamino]aniline.
Chemical Property Profile of RefChem:95744
Property Insights of RefChem:95744
The XLogP value of 2.82 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:95744. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:95744. Following Lipinski's Rule of Five, RefChem:95744 has 1 hydrogen bond donor(s) and 6 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:95744?
The CAS number of RefChem:95744 is 65121-73-5.
What is the molecular formula of RefChem:95744?
The molecular formula of RefChem:95744 is C19H23N3O4S.
What is the molecular weight of RefChem:95744?
The molecular weight of RefChem:95744 is 389.14 g/mol.
Where can I buy RefChem:95744?
You can request a quote for RefChem:95744 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:95744?
Yes, KEHONG BIO provides custom synthesis services for RefChem:95744 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.