3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile
TL;DR: 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile (CAS 476282-52-7) is a chemical compound with molecular formula C17H11Cl2N3O and molecular weight 343.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,5-dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile
Also Known As: 3-(2,5-dichlorophenyl)-2-[(2E)-1-methyl-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]-3-oxopropanenitrile
| Molecular Formula | C17H11Cl2N3O |
|---|---|
| Molecular Weight | 343.03 g/mol |
| LogP | 4.82998 |
| Topological Polar Surface Area | 61.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.02792 |
| Heavy Atoms | 23 |
| Complexity | 983.1574 |
Chemical Identifiers
| CAS Number | 476282-52-7 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N=C1C(=C(C3=C(C=CC(=C3)Cl)Cl)O)C#N |
Product Overview
3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile (CAS 476282-52-7), with molecular formula C17H11Cl2N3O and molecular weight 343.03 g/mol. IUPAC: 3-(2,5-dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile.
Chemical Property Profile of 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile
Property Insights of 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile
The XLogP value of 4.82998 indicates that 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile. Following Lipinski's Rule of Five, 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile 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 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile?
The CAS number of 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile is 476282-52-7.
What is the molecular formula of 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile?
The molecular formula of 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile is C17H11Cl2N3O.
What is the molecular weight of 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile?
The molecular weight of 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile is 343.03 g/mol.
Where can I buy 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile?
You can request a quote for 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,5-Dichlorophenyl)-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.