2-(1H-imidazol-2-ylmethylidene)propanedinitrile
TL;DR: 2-(1H-imidazol-2-ylmethylidene)propanedinitrile (CAS 82308-51-8) is a chemical compound with molecular formula C7H4N4 and molecular weight 144.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-imidazol-2-ylmethylidene)propanedinitrile
Also Known As: Tyrphostin deriv. 4, 2-(1H-imidazol-2-ylmethylidene)propanedinitrile, [(1H-Imidazol-2-yl)methylene]malononitrile, Propanedinitrile, (1H-imidazol-2-ylmethylene)-, 2-((1H-imidazol-2-yl)methylene)malononitrile
| Molecular Formula | C7H4N4 |
|---|---|
| Molecular Weight | 144.04 g/mol |
| LogP | 0.84026 |
| Topological Polar Surface Area | 76.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 144.0436 |
| Heavy Atoms | 11 |
| Complexity | 317.50775 |
Chemical Identifiers
| CAS Number | 82308-51-8 |
|---|---|
| SMILES | C1=CN=C(N1)C=C(C#N)C#N |
Product Overview
2-(1H-imidazol-2-ylmethylidene)propanedinitrile (CAS 82308-51-8), with molecular formula C7H4N4 and molecular weight 144.04 g/mol. IUPAC: 2-(1H-imidazol-2-ylmethylidene)propanedinitrile.
Chemical Property Profile of 2-(1H-imidazol-2-ylmethylidene)propanedinitrile
Property Insights of 2-(1H-imidazol-2-ylmethylidene)propanedinitrile
The XLogP value of 0.84026 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1H-imidazol-2-ylmethylidene)propanedinitrile. The TPSA of 76.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1H-imidazol-2-ylmethylidene)propanedinitrile. Following Lipinski's Rule of Five, 2-(1H-imidazol-2-ylmethylidene)propanedinitrile has 1 hydrogen bond donor(s) and 3 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-(1H-imidazol-2-ylmethylidene)propanedinitrile?
The CAS number of 2-(1H-imidazol-2-ylmethylidene)propanedinitrile is 82308-51-8.
What is the molecular formula of 2-(1H-imidazol-2-ylmethylidene)propanedinitrile?
The molecular formula of 2-(1H-imidazol-2-ylmethylidene)propanedinitrile is C7H4N4.
What is the molecular weight of 2-(1H-imidazol-2-ylmethylidene)propanedinitrile?
The molecular weight of 2-(1H-imidazol-2-ylmethylidene)propanedinitrile is 144.04 g/mol.
Where can I buy 2-(1H-imidazol-2-ylmethylidene)propanedinitrile?
You can request a quote for 2-(1H-imidazol-2-ylmethylidene)propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-imidazol-2-ylmethylidene)propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-imidazol-2-ylmethylidene)propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.