![(E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide structure](/static/products/399/399006-21-4.png)
(E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide
TL;DR: (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide (CAS 399006-21-4) is a chemical compound with molecular formula C17H12N4O2 and molecular weight 304.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-[cyano-(1-methylbenzimidazol-2-yl)methylidene]amino] benzoate
Also Known As: (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide, (E)-[cyano(1-methyl-1H-1,3-benzodiazol-2-yl)methylidene]amino benzoate, F0848-0433, [(E)-[cyano-(1-methylbenzimidazol-2-yl)methylidene]amino] benzoate, (2E)-(1-methyl-1H-benzimidazol-2-yl){[(phenylcarbonyl)oxy]imino}ethanenitrile
| Molecular Formula | C17H12N4O2 |
|---|---|
| Molecular Weight | 304.10 g/mol |
| LogP | 2.65798 |
| Topological Polar Surface Area | 80.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.09604 |
| Heavy Atoms | 23 |
| Complexity | 936.13184 |
Chemical Identifiers
| CAS Number | 399006-21-4 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N=C1/C(=N/OC(=O)C3=CC=CC=C3)/C#N |
Product Overview
(E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide (CAS 399006-21-4), with molecular formula C17H12N4O2 and molecular weight 304.10 g/mol. IUPAC: [(E)-[cyano-(1-methylbenzimidazol-2-yl)methylidene]amino] benzoate.
Chemical Property Profile of (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide
Property Insights of (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide
The XLogP value of 2.65798 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide. The TPSA of 80.27 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide. Following Lipinski's Rule of Five, (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide has 0 hydrogen bond donor(s) and 5 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 (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide?
The CAS number of (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide is 399006-21-4.
What is the molecular formula of (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide?
The molecular formula of (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide is C17H12N4O2.
What is the molecular weight of (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide?
The molecular weight of (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide is 304.10 g/mol.
Where can I buy (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide?
You can request a quote for (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(benzoyloxy)-1-methyl-1H-benzo[d]imidazole-2-carbimidoyl cyanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.