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[1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea
TL;DR: [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea (CAS 1867-06-7) is a chemical compound with molecular formula C12H11N7O and molecular weight 269.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[4-(dicyanomethyldiazenyl)phenyl]ethylideneamino]urea
Also Known As: ((p-Acetylphenyl)azo)malononitrile semicarbazone
| Molecular Formula | C12H11N7O |
|---|---|
| Molecular Weight | 269.10 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.1025 |
| Heavy Atoms | 20 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 1867-06-7 |
|---|---|
| SMILES | CC(=NNC(=O)N)C1=CC=C(C=C1)N=NC(C#N)C#N |
| InChIKey | RLIHYWZKDDBNNJ-UHFFFAOYSA-N |
Product Overview
[1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea (CAS 1867-06-7), with molecular formula C12H11N7O and molecular weight 269.10 g/mol. IUPAC: [1-[4-(dicyanomethyldiazenyl)phenyl]ethylideneamino]urea.
Chemical Property Profile of [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea
Property Insights of [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea. The TPSA of 140.0 Ų indicates high polarity, suggesting [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea has 2 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 [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea?
The CAS number of [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea is 1867-06-7.
What is the molecular formula of [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea?
The molecular formula of [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea is C12H11N7O.
What is the molecular weight of [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea?
The molecular weight of [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea is 269.10 g/mol.
Where can I buy [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea?
You can request a quote for [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea?
Yes, KEHONG BIO provides custom synthesis services for [1-[4-(Dicyanomethyldiazenyl)phenyl]ethylideneamino]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.