2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile
TL;DR: 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile (CAS 74900-38-2) is a chemical compound with molecular formula C11H7N5O2 and molecular weight 241.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile
Also Known As: 2-amino-3-{[(2-nitrophenyl)methylidene]amino}but-2-enedinitrile, 1,2-Dicyano-N-(2-nitrobenzylidene)ethenediamine, 2-amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile, (E)-2-amino-3-{[(E)-(2-nitrophenyl)methylidene]amino}-2-butenedinitrile, 2-amino-3-[(2-nitrophenyl)methyleneamino]but-2-enedinitrile
| Molecular Formula | C11H7N5O2 |
|---|---|
| Molecular Weight | 241.06 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.05997 |
| Heavy Atoms | 18 |
| Complexity | 485.0 |
Chemical Identifiers
| CAS Number | 74900-38-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=NC(=C(C#N)N)C#N)[N+](=O)[O-] |
| InChIKey | GWSCSOMMIYMXOK-UHFFFAOYSA-N |
Product Overview
2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile (CAS 74900-38-2), with molecular formula C11H7N5O2 and molecular weight 241.06 g/mol. IUPAC: 2-amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile.
Chemical Property Profile of 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile
Property Insights of 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile. Following Lipinski's Rule of Five, 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile 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 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile?
The CAS number of 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile is 74900-38-2.
What is the molecular formula of 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile?
The molecular formula of 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile is C11H7N5O2.
What is the molecular weight of 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile?
The molecular weight of 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile is 241.06 g/mol.
Where can I buy 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile?
You can request a quote for 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-3-[(2-nitrophenyl)methylideneamino]but-2-enedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.