(E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide
TL;DR: (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide (CAS 354774-73-5) is a chemical compound with molecular formula C20H17ClFN5O2 and molecular weight 413.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[4-(2-chloro-5-fluoropyrimidin-4-yl)oxyphenyl]methylideneamino]-3-(dimethylamino)benzamide
Also Known As: (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide, N'-[(E)-{4-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]phenyl}methylidene]-3-(dimethylamino)benzohydrazide, N-[(E)-[4-(2-chloro-5-fluoropyrimidin-4-yl)oxyphenyl]methylideneamino]-3-(dimethylamino)benzamide, N-{(1E)-2-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)phenyl]-1-azavinyl}[3-(dimeth ylamino)phenyl]carboxamide
| Molecular Formula | C20H17ClFN5O2 |
|---|---|
| Molecular Weight | 413.11 g/mol |
| LogP | 3.8913 |
| Topological Polar Surface Area | 79.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.10547 |
| Heavy Atoms | 29 |
| Complexity | 1041.2965 |
Chemical Identifiers
| CAS Number | 354774-73-5 |
|---|---|
| SMILES | CN(C)C1=CC=CC(=C1)C(=O)N/N=C/C2=CC=C(C=C2)OC3=NC(=NC=C3F)Cl |
Product Overview
(E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide (CAS 354774-73-5), with molecular formula C20H17ClFN5O2 and molecular weight 413.11 g/mol. IUPAC: N-[(E)-[4-(2-chloro-5-fluoropyrimidin-4-yl)oxyphenyl]methylideneamino]-3-(dimethylamino)benzamide.
Chemical Property Profile of (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide
Property Insights of (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide
The XLogP value of 3.8913 indicates that (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.71 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide. Following Lipinski's Rule of Five, (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide has 1 hydrogen bond donor(s) and 6 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'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide?
The CAS number of (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide is 354774-73-5.
What is the molecular formula of (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide?
The molecular formula of (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide is C20H17ClFN5O2.
What is the molecular weight of (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide?
The molecular weight of (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide is 413.11 g/mol.
Where can I buy (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide?
You can request a quote for (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)benzylidene)-3-(dimethylamino)benzohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.