ICR 342
TL;DR: ICR 342 (CAS 99711-15-6) is a chemical compound with molecular formula C19H21Cl3N2OS and molecular weight 430.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chloroethylsulfanyl)propyl-(6-chloro-2-methoxyacridin-9-yl)azanium chloride
Also Known As: ICR 342, 2-Methoxy-6-chloro-9-(3-(2-chloroethyl)mercaptopropylamino)acridine hydrochloride, 6-Chloro-9-(3-(2-chloroethyl)mercaptopropylamino)-2-methoxyacridine hydrochloride, Acridine, 6-chloro-9-((3-((2-chloroethyl)thio)propyl)amino)-2-methoxy-, hydrochloride, 3-(2-chloroethylsulfanyl)propyl-(6-chloro-2-methoxyacridin-9-yl)azanium chloride
| Molecular Formula | C19H21Cl3N2OS |
|---|---|
| Molecular Weight | 430.04 g/mol |
| LogP | 1.61 |
| Topological Polar Surface Area | 64.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 430.044 |
| Heavy Atoms | 26 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 99711-15-6 |
|---|---|
| SMILES | COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)[NH2+]CCCSCCCl.[Cl-] |
| InChIKey | JJGQCMTUYCANDB-UHFFFAOYSA-N |
Product Overview
ICR 342 (CAS 99711-15-6), with molecular formula C19H21Cl3N2OS and molecular weight 430.04 g/mol. IUPAC: 3-(2-chloroethylsulfanyl)propyl-(6-chloro-2-methoxyacridin-9-yl)azanium chloride.
Chemical Property Profile of ICR 342
Property Insights of ICR 342
The XLogP value of 1.61 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ICR 342. The TPSA of 64.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ICR 342. Following Lipinski's Rule of Five, ICR 342 has 1 hydrogen bond donor(s) and 4 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 ICR 342?
The CAS number of ICR 342 is 99711-15-6.
What is the molecular formula of ICR 342?
The molecular formula of ICR 342 is C19H21Cl3N2OS.
What is the molecular weight of ICR 342?
The molecular weight of ICR 342 is 430.04 g/mol.
Where can I buy ICR 342?
You can request a quote for ICR 342 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ICR 342?
Yes, KEHONG BIO provides custom synthesis services for ICR 342 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.