![2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile structure](/static/products/1025/1025261-91-9.webp)
2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile
TL;DR: 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile (CAS 1025261-91-9) is a chemical compound with molecular formula C13H9N5O2 and molecular weight 267.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-[3-(2-nitrophenyl)prop-2-enylideneamino]but-2-enedinitrile
Also Known As: 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile, 2-amino-3-[3-(2-nitrophenyl)prop-2-enylideneamino]but-2-enedinitrile, (Z)-2-amino-3-{[(E,2E)-3-(2-nitrophenyl)-2-propenylidene]amino}-2-butenedinitrile, (2Z)-2-amino-3-[(E)-[(2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino]but-2-enedinitrile
| Molecular Formula | C13H9N5O2 |
|---|---|
| Molecular Weight | 267.08 g/mol |
| LogP | 1.89626 |
| Topological Polar Surface Area | 129.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 267.07562 |
| Heavy Atoms | 20 |
| Complexity | 689.4484 |
Chemical Identifiers
| CAS Number | 1025261-91-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=CC=NC(=C(C#N)N)C#N)[N+](=O)[O-] |
Product Overview
2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile (CAS 1025261-91-9), with molecular formula C13H9N5O2 and molecular weight 267.08 g/mol. IUPAC: 2-amino-3-[3-(2-nitrophenyl)prop-2-enylideneamino]but-2-enedinitrile.
Chemical Property Profile of 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile
Property Insights of 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile
The XLogP value of 1.89626 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile. The TPSA of 129.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile. Following Lipinski's Rule of Five, 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}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-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile?
The CAS number of 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile is 1025261-91-9.
What is the molecular formula of 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile?
The molecular formula of 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile is C13H9N5O2.
What is the molecular weight of 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile?
The molecular weight of 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile is 267.08 g/mol.
Where can I buy 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile?
You can request a quote for 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}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-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-3-{[3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}but-2-enedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.