RefChem:221069
TL;DR: RefChem:221069 (CAS 19803-63-5) is a chemical compound with molecular formula C21H28Cl4N10 and molecular weight 560.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N',4-N'-bis[N'-(4-chlorophenyl)carbamimidoyl]-2-methylpiperazine-1,4-dicarboximidamide;dihydrochloride
Also Known As: C21H26Cl2N10.2ClH.1/2H2O, N,N''-Bis((p-chlorophenyl)amidino)-2-methyl-1,4-piperazinedicarboxamidine HCl hydrate, C21-H26-Cl2-N10.2Cl-H.1/2H2-O, 1,4-Piperazinedicarboxamidine, N,N''-bis((p-chlorophenyl)amidino)-2-methyl-, hydrochloride, hydrate (2:4:1), N~1~,N~4~-Bis[N-(4-chlorophenyl)carbamimidoyl]-2-methylpiperazine-1,4-dicarboximidamide--hydrogen chloride (1/2)
| Molecular Formula | C21H28Cl4N10 |
|---|---|
| Molecular Weight | 560.13 g/mol |
| LogP | 3.0651 |
| Topological Polar Surface Area | 160.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 560.12524 |
| Heavy Atoms | 35 |
| Complexity | 1084.2891 |
Chemical Identifiers
| CAS Number | 19803-63-5 |
|---|---|
| SMILES | CC1CN(CCN1/C(=N/C(=NC2=CC=C(C=C2)Cl)N)/N)/C(=N/C(=NC3=CC=C(C=C3)Cl)N)/N.Cl.Cl |
Product Overview
RefChem:221069 (CAS 19803-63-5), with molecular formula C21H28Cl4N10 and molecular weight 560.13 g/mol. IUPAC: 1-N',4-N'-bis[N'-(4-chlorophenyl)carbamimidoyl]-2-methylpiperazine-1,4-dicarboximidamide;dihydrochloride.
Chemical Property Profile of RefChem:221069
Property Insights of RefChem:221069
The XLogP value of 3.0651 indicates that RefChem:221069 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 160.0 Ų indicates high polarity, suggesting RefChem:221069 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:221069 has 4 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:221069?
The CAS number of RefChem:221069 is 19803-63-5.
What is the molecular formula of RefChem:221069?
The molecular formula of RefChem:221069 is C21H28Cl4N10.
What is the molecular weight of RefChem:221069?
The molecular weight of RefChem:221069 is 560.13 g/mol.
Where can I buy RefChem:221069?
You can request a quote for RefChem:221069 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:221069?
Yes, KEHONG BIO provides custom synthesis services for RefChem:221069 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.