Bipiperidyl mustard
TL;DR: Bipiperidyl mustard (CAS 6802-93-3) is a chemical compound with molecular formula C14H26Cl2N2 and molecular weight 292.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)-4-[1-(2-chloroethyl)piperidin-4-yl]piperidine
Also Known As: Bipiperidyl mustard, 1,1'-Bis(2-chloroethyl)-4,4'-bipiperidine, 3-methoxy-4-fluorobenzylcyanide, BIPIPERIDYL MUSTARD [MI], N,N'-Bis(beta-chloroethyl)-4,4'-bipiperidine
| Molecular Formula | C14H26Cl2N2 |
|---|---|
| Molecular Weight | 292.15 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 292.1473 |
| Heavy Atoms | 18 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 6802-93-3 |
|---|---|
| SMILES | C1CN(CCC1C2CCN(CC2)CCCl)CCCl |
| InChIKey | JQIFJRXHLHKEAJ-UHFFFAOYSA-N |
Product Overview
Bipiperidyl mustard (CAS 6802-93-3), with molecular formula C14H26Cl2N2 and molecular weight 292.15 g/mol. IUPAC: 1-(2-chloroethyl)-4-[1-(2-chloroethyl)piperidin-4-yl]piperidine.
Chemical Property Profile of Bipiperidyl mustard
Property Insights of Bipiperidyl mustard
The XLogP value of 3.0 indicates that Bipiperidyl mustard is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.5 Ų, Bipiperidyl mustard exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bipiperidyl mustard has 0 hydrogen bond donor(s) and 2 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 Bipiperidyl mustard?
The CAS number of Bipiperidyl mustard is 6802-93-3.
What is the molecular formula of Bipiperidyl mustard?
The molecular formula of Bipiperidyl mustard is C14H26Cl2N2.
What is the molecular weight of Bipiperidyl mustard?
The molecular weight of Bipiperidyl mustard is 292.15 g/mol.
Where can I buy Bipiperidyl mustard?
You can request a quote for Bipiperidyl mustard directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bipiperidyl mustard?
Yes, KEHONG BIO provides custom synthesis services for Bipiperidyl mustard and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.