C35H34N4O.2ClH.1/2H2O
TL;DR: C35H34N4O.2ClH.1/2H2O (CAS 66725-02-8) is a chemical compound with molecular formula C35H36Cl2N4O and molecular weight 598.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acridin-9-yl-[2-[7-(quinolin-4-ylazaniumyl)heptoxy]phenyl]azanium dichloride
Also Known As: C35H34N4O.2ClH.1/2H2O, C35-H34-N4-O.2Cl-H.1/2H2-O, Acridine, 9-(o-(7-(4-quinolinylamino)heptyloxy)anilino)-, dihydrochloride, hemihydrate, 9-(o-(7-(4-Quinolinylamino)heptyloxy)anilino)acridine dihydrochloride hemihydrate, acridin-9-yl-[2-[7-(quinolin-4-ylazaniumyl)heptoxy]phenyl]azanium dichloride
| Molecular Formula | C35H36Cl2N4O |
|---|---|
| Molecular Weight | 598.23 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 598.2266 |
| Heavy Atoms | 42 |
| Complexity | 712.0 |
Chemical Identifiers
| CAS Number | 66725-02-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC=N2)[NH2+]CCCCCCCOC3=CC=CC=C3[NH2+]C4=C5C=CC=CC5=NC6=CC=CC=C64.[Cl-].[Cl-] |
| InChIKey | XPQLGOYEUHITOR-UHFFFAOYSA-N |
Product Overview
C35H34N4O.2ClH.1/2H2O (CAS 66725-02-8), with molecular formula C35H36Cl2N4O and molecular weight 598.23 g/mol. IUPAC: acridin-9-yl-[2-[7-(quinolin-4-ylazaniumyl)heptoxy]phenyl]azanium dichloride.
Chemical Property Profile of C35H34N4O.2ClH.1/2H2O
Property Insights of C35H34N4O.2ClH.1/2H2O
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C35H34N4O.2ClH.1/2H2O. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for C35H34N4O.2ClH.1/2H2O. Following Lipinski's Rule of Five, C35H34N4O.2ClH.1/2H2O has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C35H34N4O.2ClH.1/2H2O?
The CAS number of C35H34N4O.2ClH.1/2H2O is 66725-02-8.
What is the molecular formula of C35H34N4O.2ClH.1/2H2O?
The molecular formula of C35H34N4O.2ClH.1/2H2O is C35H36Cl2N4O.
What is the molecular weight of C35H34N4O.2ClH.1/2H2O?
The molecular weight of C35H34N4O.2ClH.1/2H2O is 598.23 g/mol.
Where can I buy C35H34N4O.2ClH.1/2H2O?
You can request a quote for C35H34N4O.2ClH.1/2H2O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C35H34N4O.2ClH.1/2H2O?
Yes, KEHONG BIO provides custom synthesis services for C35H34N4O.2ClH.1/2H2O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.