(E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide
TL;DR: (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide (CAS 159143-02-9) is a chemical compound with molecular formula C23H22N6O3S and molecular weight 462.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-benzylideneamino]-2-[2-[2-[(2E)-2-benzylidenehydrazinyl]-2-oxoethyl]sulfanyl-6-methylpyrimidin-4-yl]oxyacetamide
Also Known As: (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide, N-[(E)-benzylideneamino]-2-[2-[2-[(2E)-2-benzylidenehydrazinyl]-2-oxoethyl]sulfanyl-6-methylpyrimidin-4-yl]oxyacetamide
| Molecular Formula | C23H22N6O3S |
|---|---|
| Molecular Weight | 462.15 g/mol |
| LogP | 2.55652 |
| Topological Polar Surface Area | 117.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 462.1474 |
| Heavy Atoms | 33 |
| Complexity | 1037.8053 |
Chemical Identifiers
| CAS Number | 159143-02-9 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)SCC(=O)N/N=C/C2=CC=CC=C2)OCC(=O)N/N=C/C3=CC=CC=C3 |
Product Overview
(E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide (CAS 159143-02-9), with molecular formula C23H22N6O3S and molecular weight 462.15 g/mol. IUPAC: N-[(E)-benzylideneamino]-2-[2-[2-[(2E)-2-benzylidenehydrazinyl]-2-oxoethyl]sulfanyl-6-methylpyrimidin-4-yl]oxyacetamide.
Chemical Property Profile of (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide
Property Insights of (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide
The XLogP value of 2.55652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide. The TPSA of 117.93 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide. Following Lipinski's Rule of Five, (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide has 2 hydrogen bond donor(s) and 8 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'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide?
The CAS number of (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide is 159143-02-9.
What is the molecular formula of (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide?
The molecular formula of (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide is C23H22N6O3S.
What is the molecular weight of (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide?
The molecular weight of (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide is 462.15 g/mol.
Where can I buy (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide?
You can request a quote for (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-benzylidene-2-((4-(2-((E)-2-benzylidenehydrazinyl)-2-oxoethoxy)-6-methylpyrimidin-2-yl)thio)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.