N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride
TL;DR: N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride (CAS 133041-56-2) is a chemical compound with molecular formula C26H25Cl3N4O and molecular weight 514.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[bis(2-chloroethyl)amino]phenyl]-4-(quinolin-4-ylamino)benzamide;hydrochloride
Also Known As: N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride, N-[4-[bis amino]phenyl]-4- benzamidehydrochloride, N-[4-[bis(2-chloroethyl)amino]phenyl]-4-(quinolin-4-ylamino)benzamide;hydrochloride, 2-[2-(5-Bromo-1H-indol-3-yl)ethyl]-3-[3-(1-methylethoxy )phenyl]-4-(3H)-quinazolinone, N-[4-[bis(2-chloroethyl)amino]phenyl]-4-(quinolin-4-ylamino)benzamide hydrochloride
| Molecular Formula | C26H25Cl3N4O |
|---|---|
| Molecular Weight | 514.11 g/mol |
| LogP | 6.9365 |
| Topological Polar Surface Area | 57.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 514.1094 |
| Heavy Atoms | 34 |
| Complexity | 1205.641 |
Chemical Identifiers
| CAS Number | 133041-56-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC=N2)NC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)N(CCCl)CCCl.Cl |
Product Overview
N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride (CAS 133041-56-2), with molecular formula C26H25Cl3N4O and molecular weight 514.11 g/mol. IUPAC: N-[4-[bis(2-chloroethyl)amino]phenyl]-4-(quinolin-4-ylamino)benzamide;hydrochloride.
Chemical Property Profile of N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride
Property Insights of N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride
The XLogP value of 6.9365 indicates that N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.26 Ų, N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride has 2 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-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride?
The CAS number of N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride is 133041-56-2.
What is the molecular formula of N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride?
The molecular formula of N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride is C26H25Cl3N4O.
What is the molecular weight of N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride?
The molecular weight of N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride is 514.11 g/mol.
Where can I buy N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride?
You can request a quote for N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for N-(4-(Bis(2-chloroethyl)amino)phenyl)-4-(4-quinolinylamino)benzamide monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.