(E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide
TL;DR: (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide (CAS 369393-48-6) is a chemical compound with molecular formula C18H11ClFIN4O2 and molecular weight 495.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[3-(2-chloro-5-fluoropyrimidin-4-yl)oxyphenyl]methylideneamino]-3-iodobenzamide
Also Known As: (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide, N'-[(E)-{3-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]phenyl}methylidene]-3-iodobenzohydrazide, N-[(E)-[3-(2-chloro-5-fluoropyrimidin-4-yl)oxyphenyl]methylideneamino]-3-iodobenzamide, N-[[3-(2-chloro-5-fluoro-pyrimidin-4-yl)oxyphenyl]methylideneamino]-3-iodo-benzamide, N-{(1E)-2-[3-(2-chloro-5-fluoropyrimidin-4-yloxy)phenyl]-1-azavinyl}(3-iodophe nyl)carboxamide
| Molecular Formula | C18H11ClFIN4O2 |
|---|---|
| Molecular Weight | 495.96 g/mol |
| LogP | 4.4299 |
| Topological Polar Surface Area | 76.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 495.95993 |
| Heavy Atoms | 27 |
| Complexity | 1016.15674 |
Chemical Identifiers
| CAS Number | 369393-48-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC2=NC(=NC=C2F)Cl)/C=N/NC(=O)C3=CC(=CC=C3)I |
Product Overview
(E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide (CAS 369393-48-6), with molecular formula C18H11ClFIN4O2 and molecular weight 495.96 g/mol. IUPAC: N-[(E)-[3-(2-chloro-5-fluoropyrimidin-4-yl)oxyphenyl]methylideneamino]-3-iodobenzamide.
Chemical Property Profile of (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide
Property Insights of (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide
The XLogP value of 4.4299 indicates that (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.47 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide. Following Lipinski's Rule of Five, (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide has 1 hydrogen bond donor(s) and 5 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 (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide?
The CAS number of (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide is 369393-48-6.
What is the molecular formula of (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide?
The molecular formula of (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide is C18H11ClFIN4O2.
What is the molecular weight of (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide?
The molecular weight of (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide is 495.96 g/mol.
Where can I buy (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide?
You can request a quote for (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-(3-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-iodobenzohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.