(E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate
TL;DR: (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate (CAS 324064-54-2) is a chemical compound with molecular formula C23H16BrN5O5S and molecular weight 553.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl] (1E)-N-(4-methoxyanilino)-2-(4-nitrophenyl)-2-oxoethanimidothioate
Also Known As: (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate, F0807-0303, (2E)-2-{[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-2-[2-(4-methoxyphenyl)hydrazin-1-ylidene]-1-(4-nitrophenyl)ethan-1-one, [5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl] (1E)-N-(4-methoxyanilino)-2-(4-nitrophenyl)-2-oxoethanimidothioate, (2E)-2-[5-(3-bromophenyl)(1,3,4-oxadiazol-2-yl)thio]-3-[(4-methoxyphenyl)amino ]-1-(4-nitrophenyl)-3-azaprop-2-en-1-one
| Molecular Formula | C23H16BrN5O5S |
|---|---|
| Molecular Weight | 553.01 g/mol |
| LogP | 5.8165 |
| Topological Polar Surface Area | 132.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 553.00555 |
| Heavy Atoms | 35 |
| Complexity | 1390.1996 |
Chemical Identifiers
| CAS Number | 324064-54-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N/N=C(\C(=O)C2=CC=C(C=C2)[N+](=O)[O-])/SC3=NN=C(O3)C4=CC(=CC=C4)Br |
Product Overview
(E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate (CAS 324064-54-2), with molecular formula C23H16BrN5O5S and molecular weight 553.01 g/mol. IUPAC: [5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl] (1E)-N-(4-methoxyanilino)-2-(4-nitrophenyl)-2-oxoethanimidothioate.
Chemical Property Profile of (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate
Property Insights of (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate
The XLogP value of 5.8165 indicates that (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 132.75 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate. Following Lipinski's Rule of Five, (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate?
The CAS number of (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate is 324064-54-2.
What is the molecular formula of (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate?
The molecular formula of (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate is C23H16BrN5O5S.
What is the molecular weight of (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate?
The molecular weight of (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate is 553.01 g/mol.
Where can I buy (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate?
You can request a quote for (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl N'-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-oxoethanehydrazonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.