(5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile
TL;DR: (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile (CAS 391228-73-2) is a chemical compound with molecular formula C14H8BrN3OS and molecular weight 344.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-yl)-3-(5-bromothiophen-2-yl)-3-hydroxyprop-2-enenitrile
Also Known As: F0193-0287, (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile, 3-(5-bromothiophen-2-yl)-2-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-3-oxopropanenitrile
| Molecular Formula | C14H8BrN3OS |
|---|---|
| Molecular Weight | 344.96 g/mol |
| LogP | 4.33678 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 344.95715 |
| Heavy Atoms | 20 |
| Complexity | 823.5566 |
Chemical Identifiers
| CAS Number | 391228-73-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)C(=C(C3=CC=C(S3)Br)O)C#N |
Product Overview
(5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile (CAS 391228-73-2), with molecular formula C14H8BrN3OS and molecular weight 344.96 g/mol. IUPAC: 2-(1H-benzimidazol-2-yl)-3-(5-bromothiophen-2-yl)-3-hydroxyprop-2-enenitrile.
Chemical Property Profile of (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile
Property Insights of (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile
The XLogP value of 4.33678 indicates that (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile. Following Lipinski's Rule of Five, (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile has 2 hydrogen bond donor(s) and 4 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 (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile?
The CAS number of (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile is 391228-73-2.
What is the molecular formula of (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile?
The molecular formula of (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile is C14H8BrN3OS.
What is the molecular weight of (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile?
The molecular weight of (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile is 344.96 g/mol.
Where can I buy (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile?
You can request a quote for (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for (5-bromo-2-thenoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.