![3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one structure](/static/products/678/6781-81-3.png)
3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one
TL;DR: 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one (CAS 6781-81-3) is a chemical compound with molecular formula C21H18Cl3NO2 and molecular weight 421.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-[bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one
Also Known As: 3-[[4-[bis(2-chloroethyl)amino]phenyl]methylene]-5-(4-chloro, 2(3H)-Furanone,3-[[4-[bis(2-chloroethyl)amino]phenyl]methylene]-5-(4-chlorophenyl)-, 3-[[4-[bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one
| Molecular Formula | C21H18Cl3NO2 |
|---|---|
| Molecular Weight | 421.04 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 421.0403 |
| Heavy Atoms | 27 |
| Complexity | 556.0 |
Chemical Identifiers
| CAS Number | 6781-81-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C=C2C=C(OC2=O)C3=CC=C(C=C3)Cl)N(CCCl)CCCl |
| InChIKey | UCFKNLGXMYXTGE-UHFFFAOYSA-N |
Product Overview
3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one (CAS 6781-81-3), with molecular formula C21H18Cl3NO2 and molecular weight 421.04 g/mol. IUPAC: 3-[[4-[bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one.
Chemical Property Profile of 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one
Property Insights of 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one
The XLogP value of 5.9 indicates that 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one?
The CAS number of 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one is 6781-81-3.
What is the molecular formula of 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one?
The molecular formula of 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one is C21H18Cl3NO2.
What is the molecular weight of 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one?
The molecular weight of 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one is 421.04 g/mol.
Where can I buy 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one?
You can request a quote for 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[[4-[Bis(2-chloroethyl)amino]phenyl]methylidene]-5-(4-chlorophenyl)furan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.