RefChem:317083
TL;DR: RefChem:317083 (CAS 73680-44-1) is a chemical compound with molecular formula C29H36Cl3N3O2 and molecular weight 563.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(6-chloro-2-methoxyacridin-9-yl)azaniumyl]-4-(4-methoxyphenyl)butyl]-diethylazanium dichloride
Also Known As: Acridine, 3-chloro-9-(4-(diethylamino)-1-(4-methoxyphenyl)butylamino)-7-methoxy-, dihydrochloride, hydrate, [4-[(6-chloro-2-methoxyacridin-9-yl)azaniumyl]-4-(4-methoxyphenyl)butyl]-diethylazanium dichloride, ACRIDINE, 3-CHLORO-9-(4-(DIETHYLAMINO)-1-(4-METHOXYPHENYL)BUTYLAMINO)-7-METHOXY-, 1,4-Butanediamine, N'-(6-chloro-2-methoxy-9-acridinyl)-N,N-diethyl-4-(4-methoxyphenyl)-, dihydrochloride, monohydrate, RefChem:317083
| Molecular Formula | C29H36Cl3N3O2 |
|---|---|
| Molecular Weight | 563.19 g/mol |
| LogP | -1.29 |
| Topological Polar Surface Area | 52.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 563.1873 |
| Heavy Atoms | 37 |
| Complexity | 613.0 |
Chemical Identifiers
| CAS Number | 73680-44-1 |
|---|---|
| SMILES | CC[NH+](CC)CCCC(C1=CC=C(C=C1)OC)[NH2+]C2=C3C=C(C=CC3=NC4=C2C=CC(=C4)Cl)OC.[Cl-].[Cl-] |
| InChIKey | HQKWZMXOXRBTEK-UHFFFAOYSA-N |
Product Overview
RefChem:317083 (CAS 73680-44-1), with molecular formula C29H36Cl3N3O2 and molecular weight 563.19 g/mol. IUPAC: [4-[(6-chloro-2-methoxyacridin-9-yl)azaniumyl]-4-(4-methoxyphenyl)butyl]-diethylazanium dichloride.
Chemical Property Profile of RefChem:317083
Property Insights of RefChem:317083
The XLogP value of -1.29 indicates that RefChem:317083 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.4 Ų, RefChem:317083 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:317083 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 RefChem:317083?
The CAS number of RefChem:317083 is 73680-44-1.
What is the molecular formula of RefChem:317083?
The molecular formula of RefChem:317083 is C29H36Cl3N3O2.
What is the molecular weight of RefChem:317083?
The molecular weight of RefChem:317083 is 563.19 g/mol.
Where can I buy RefChem:317083?
You can request a quote for RefChem:317083 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:317083?
Yes, KEHONG BIO provides custom synthesis services for RefChem:317083 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.