Propylquinacrine mustard dihydrochloride
TL;DR: Propylquinacrine mustard dihydrochloride (CAS 1091-27-6) is a chemical compound with molecular formula C21H26Cl5N3O and molecular weight 511.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N',N'-bis(2-chloroethyl)-N-(6-chloro-2-methoxyacridin-9-yl)propane-1,3-diamine;dihydrochloride
Also Known As: Propyl quinacrine mustard, Propy quinacrine mustard, Propylquinacrine mustard dihydrochloride, n,n-bis(2-chloroethyl)-n'-(6-chloro-2-methoxyacridin-9-yl)propane-1,3-diamine dihydrochloride, 1,3-Propanediamine, N,N-bis(2-chloroethyl)-N'-(6-chloro-2-methoxy-9-acridinyl)-, dihydrochloride
| Molecular Formula | C21H26Cl5N3O |
|---|---|
| Molecular Weight | 511.05 g/mol |
| LogP | 6.4752 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 511.05185 |
| Heavy Atoms | 30 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 1091-27-6 |
|---|---|
| SMILES | COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCCN(CCCl)CCCl.Cl.Cl |
| InChIKey | LZQMOICOADYSJP-UHFFFAOYSA-N |
Product Overview
Propylquinacrine mustard dihydrochloride (CAS 1091-27-6), with molecular formula C21H26Cl5N3O and molecular weight 511.05 g/mol. IUPAC: N',N'-bis(2-chloroethyl)-N-(6-chloro-2-methoxyacridin-9-yl)propane-1,3-diamine;dihydrochloride.
Chemical Property Profile of Propylquinacrine mustard dihydrochloride
Property Insights of Propylquinacrine mustard dihydrochloride
The XLogP value of 6.4752 indicates that Propylquinacrine mustard dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, Propylquinacrine mustard dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propylquinacrine mustard dihydrochloride has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Propylquinacrine mustard dihydrochloride?
The CAS number of Propylquinacrine mustard dihydrochloride is 1091-27-6.
What is the molecular formula of Propylquinacrine mustard dihydrochloride?
The molecular formula of Propylquinacrine mustard dihydrochloride is C21H26Cl5N3O.
What is the molecular weight of Propylquinacrine mustard dihydrochloride?
The molecular weight of Propylquinacrine mustard dihydrochloride is 511.05 g/mol.
Where can I buy Propylquinacrine mustard dihydrochloride?
You can request a quote for Propylquinacrine mustard dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propylquinacrine mustard dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Propylquinacrine mustard dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.