2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile
TL;DR: 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile (CAS 1159976-55-2) is a chemical compound with molecular formula C11H7BrN4 and molecular weight 273.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-[(3-bromophenyl)methylideneamino]but-2-enedinitrile
Also Known As: 2-amino-3-[(3-bromophenyl)methylideneamino]but-2-enedinitrile, 2-amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile, 2-amino-3-[(3-bromophenyl)methyleneamino]but-2-enedinitrile
| Molecular Formula | C11H7BrN4 |
|---|---|
| Molecular Weight | 273.99 g/mol |
| LogP | 2.08546 |
| Topological Polar Surface Area | 85.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.9854 |
| Heavy Atoms | 16 |
| Complexity | 531.65094 |
Chemical Identifiers
| CAS Number | 1159976-55-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C=NC(=C(C#N)N)C#N |
Product Overview
2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile (CAS 1159976-55-2), with molecular formula C11H7BrN4 and molecular weight 273.99 g/mol. IUPAC: 2-amino-3-[(3-bromophenyl)methylideneamino]but-2-enedinitrile.
Chemical Property Profile of 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile
Property Insights of 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile
The XLogP value of 2.08546 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile. The TPSA of 85.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile. Following Lipinski's Rule of Five, 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile has 1 hydrogen bond donor(s) and 4 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 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile?
The CAS number of 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile is 1159976-55-2.
What is the molecular formula of 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile?
The molecular formula of 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile is C11H7BrN4.
What is the molecular weight of 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile?
The molecular weight of 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile is 273.99 g/mol.
Where can I buy 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile?
You can request a quote for 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-1-(1-aza-2-(3-bromophenyl)vinyl)ethene-1,2-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.