N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine
TL;DR: N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine (CAS 130031-47-9) is a chemical compound with molecular formula C27H29Cl2N3O and molecular weight 481.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[4-[bis(2-chloroethyl)amino]phenoxy]butyl]acridin-9-amine
Also Known As: N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine, N-[4-[4-[bis(2-chloroethyl)amino]phenoxy]butyl]acridin-9-amine, 9-Acridinamine,N-[4-[4-[bis(2-chloroethyl)amino]phenoxy]butyl]-, N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)acridin-9-amine, 9-[4-[4-[Bis(2-chloroethyl)amino]phenoxy]butylamino]acridine
| Molecular Formula | C27H29Cl2N3O |
|---|---|
| Molecular Weight | 481.17 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 481.16876 |
| Heavy Atoms | 33 |
| Complexity | 517.0 |
Chemical Identifiers
| CAS Number | 130031-47-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCCOC4=CC=C(C=C4)N(CCCl)CCCl |
| InChIKey | MKTIVVJZHNSTFA-UHFFFAOYSA-N |
Product Overview
N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine (CAS 130031-47-9), with molecular formula C27H29Cl2N3O and molecular weight 481.17 g/mol. IUPAC: N-[4-[4-[bis(2-chloroethyl)amino]phenoxy]butyl]acridin-9-amine.
Chemical Property Profile of N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine
Property Insights of N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine
The XLogP value of 7.2 indicates that N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine has 1 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 N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine?
The CAS number of N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine is 130031-47-9.
What is the molecular formula of N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine?
The molecular formula of N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine is C27H29Cl2N3O.
What is the molecular weight of N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine?
The molecular weight of N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine is 481.17 g/mol.
Where can I buy N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine?
You can request a quote for N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine?
Yes, KEHONG BIO provides custom synthesis services for N-(4-(4-(Bis(2-chloroethyl)amino)phenoxy)butyl)-9-acridinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.