A2011/0084441
TL;DR: A2011/0084441 (CAS 312529-69-4) is a chemical compound with molecular formula C19H15BrN4OS2 and molecular weight 457.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-[[2-[(4-bromophenyl)methoxy]phenyl]methylidene]hydrazinyl]-3-methylsulfanyl-1,2-thiazole-4-carbonitrile
Also Known As: A2011/0084441, 5-[2-[[2-[(4-Bromophenyl)methoxy]phenyl]methylene]hydrazinyl]-3-(methylthio)-4-isothiazolecarbonitrile, 5-[2-({2-[(4-Bromophenyl)methoxy]phenyl}methylidene)hydrazinyl]-3-(methylsulfanyl)-1,2-thiazole-4-carbonitrile, 5-[2-[[2-[(4-bromophenyl)methoxy]phenyl]methylidene]hydrazinyl]-3-methylsulfanyl-1,2-thiazole-4-carbonitrile
| Molecular Formula | C19H15BrN4OS2 |
|---|---|
| Molecular Weight | 457.99 g/mol |
| LogP | 5.52418 |
| Topological Polar Surface Area | 70.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 457.98706 |
| Heavy Atoms | 27 |
| Complexity | 980.1199 |
Chemical Identifiers
| CAS Number | 312529-69-4 |
|---|---|
| SMILES | CSC1=NSC(=C1C#N)NN=CC2=CC=CC=C2OCC3=CC=C(C=C3)Br |
Product Overview
A2011/0084441 (CAS 312529-69-4), with molecular formula C19H15BrN4OS2 and molecular weight 457.99 g/mol. IUPAC: 5-[2-[[2-[(4-bromophenyl)methoxy]phenyl]methylidene]hydrazinyl]-3-methylsulfanyl-1,2-thiazole-4-carbonitrile.
Chemical Property Profile of A2011/0084441
Property Insights of A2011/0084441
The XLogP value of 5.52418 indicates that A2011/0084441 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.3 Ų falls within the moderate polarity range, balancing permeability and solubility for A2011/0084441. Following Lipinski's Rule of Five, A2011/0084441 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2011/0084441?
The CAS number of A2011/0084441 is 312529-69-4.
What is the molecular formula of A2011/0084441?
The molecular formula of A2011/0084441 is C19H15BrN4OS2.
What is the molecular weight of A2011/0084441?
The molecular weight of A2011/0084441 is 457.99 g/mol.
Where can I buy A2011/0084441?
You can request a quote for A2011/0084441 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2011/0084441?
Yes, KEHONG BIO provides custom synthesis services for A2011/0084441 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.