ICR 427
TL;DR: ICR 427 (CAS 38915-15-0) is a chemical compound with molecular formula C18H20Cl2N2OS and molecular weight 382.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chloroethylsulfanyl)ethyl-(4-methoxyacridin-9-yl)azanium chloride
Also Known As: ICR 427, C18H19ClN2OS.ClH.1/2H2O, C18-H19-Cl-N2-O-S.Cl-H.1/2H2-O, 9-((2-((2-Chloroethyl)thio)ethyl)amino)-4-methoxyacridine hydrochloride hemihydrate, 2-(2-chloroethylsulfanyl)ethyl-(4-methoxyacridin-9-yl)azanium chloride
| Molecular Formula | C18H20Cl2N2OS |
|---|---|
| Molecular Weight | 382.07 g/mol |
| LogP | 0.57 |
| Topological Polar Surface Area | 64.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 382.06735 |
| Heavy Atoms | 24 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 38915-15-0 |
|---|---|
| SMILES | COC1=CC=CC2=C(C3=CC=CC=C3N=C21)[NH2+]CCSCCCl.[Cl-] |
| InChIKey | NGVOEDDNBXEUTH-UHFFFAOYSA-N |
Product Overview
ICR 427 (CAS 38915-15-0), with molecular formula C18H20Cl2N2OS and molecular weight 382.07 g/mol. IUPAC: 2-(2-chloroethylsulfanyl)ethyl-(4-methoxyacridin-9-yl)azanium chloride.
Chemical Property Profile of ICR 427
Property Insights of ICR 427
The XLogP value of 0.57 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ICR 427. The TPSA of 64.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ICR 427. Following Lipinski's Rule of Five, ICR 427 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 427?
The CAS number of ICR 427 is 38915-15-0.
What is the molecular formula of ICR 427?
The molecular formula of ICR 427 is C18H20Cl2N2OS.
What is the molecular weight of ICR 427?
The molecular weight of ICR 427 is 382.07 g/mol.
Where can I buy ICR 427?
You can request a quote for ICR 427 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ICR 427?
Yes, KEHONG BIO provides custom synthesis services for ICR 427 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.