N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline
TL;DR: N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline (CAS 91933-15-2) is a chemical compound with molecular formula C22H22Cl2N4O2 and molecular weight 444.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-6-methyl-[1,3]dioxolo[4,5-g]quinolin-8-amine
Also Known As: N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline, N-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-6-methyl-[1,3]dioxolo[4,5-g]quinolin-8-amine
| Molecular Formula | C22H22Cl2N4O2 |
|---|---|
| Molecular Weight | 444.11 g/mol |
| LogP | 5.00192 |
| Topological Polar Surface Area | 58.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 444.11197 |
| Heavy Atoms | 30 |
| Complexity | 1051.182 |
Chemical Identifiers
| CAS Number | 91933-15-2 |
|---|---|
| SMILES | CC1=CC(=C2C=C3C(=CC2=N1)OCO3)N/N=C/C4=CC=C(C=C4)N(CCCl)CCCl |
Product Overview
N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline (CAS 91933-15-2), with molecular formula C22H22Cl2N4O2 and molecular weight 444.11 g/mol. IUPAC: N-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-6-methyl-[1,3]dioxolo[4,5-g]quinolin-8-amine.
Chemical Property Profile of N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline
Property Insights of N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline
The XLogP value of 5.00192 indicates that N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.98 Ų, N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline?
The CAS number of N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline is 91933-15-2.
What is the molecular formula of N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline?
The molecular formula of N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline is C22H22Cl2N4O2.
What is the molecular weight of N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline?
The molecular weight of N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline is 444.11 g/mol.
Where can I buy N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline?
You can request a quote for N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-Bis(2-chloroethyl)-4-{(E)-[2-(6-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-8-yl)hydrazinylidene]methyl}aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.