![4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide structure](/static/products/1959/1959-66-6.webp)
4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide
TL;DR: 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide (CAS 1959-66-6) is a chemical compound with molecular formula C18H18Cl2FN3O and molecular weight 381.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide
Also Known As: 4-[bis(2-chloroethyl)amino]-N-[(E)-(4-fluorophenyl)methylide, 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide
| Molecular Formula | C18H18Cl2FN3O |
|---|---|
| Molecular Weight | 381.08 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 381.0811 |
| Heavy Atoms | 25 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 1959-66-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C=NNC(=O)C2=CC=C(C=C2)N(CCCl)CCCl)F |
| InChIKey | ZGYIRHRXHQPFNZ-UHFFFAOYSA-N |
Product Overview
4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide (CAS 1959-66-6), with molecular formula C18H18Cl2FN3O and molecular weight 381.08 g/mol. IUPAC: 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide.
Chemical Property Profile of 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide
Property Insights of 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide
The XLogP value of 4.0 indicates that 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.7 Ų, 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide has 1 hydrogen bond donor(s) and 4 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 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide?
The CAS number of 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide is 1959-66-6.
What is the molecular formula of 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide?
The molecular formula of 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide is C18H18Cl2FN3O.
What is the molecular weight of 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide?
The molecular weight of 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide is 381.08 g/mol.
Where can I buy 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide?
You can request a quote for 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[bis(2-chloroethyl)amino]-N-[(4-fluorophenyl)methylideneamino]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.