![3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile structure](/static/products/3104/310457-65-9.webp)
3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile
TL;DR: 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile (CAS 310457-65-9) is a chemical compound with molecular formula C17H13Cl2N3O and molecular weight 345.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-[(2,4-dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile
Also Known As: BAS 00444490, 3-[2-[(2,4-dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile, A0848/0039704, 3-{2-[(2,4-dichlorophenoxy)methyl]benzimidazolyl}propanenitrile, 3-[2-(2,4-Dichloro-phenoxymethyl)-benzoimidazol-1-yl]-propionitrile
| Molecular Formula | C17H13Cl2N3O |
|---|---|
| Molecular Weight | 345.04 g/mol |
| LogP | 4.83578 |
| Topological Polar Surface Area | 50.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.04358 |
| Heavy Atoms | 23 |
| Complexity | 883.16614 |
Chemical Identifiers
| CAS Number | 310457-65-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(N2CCC#N)COC3=C(C=C(C=C3)Cl)Cl |
Product Overview
3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile (CAS 310457-65-9), with molecular formula C17H13Cl2N3O and molecular weight 345.04 g/mol. IUPAC: 3-[2-[(2,4-dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile.
Chemical Property Profile of 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile
Property Insights of 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile
The XLogP value of 4.83578 indicates that 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.84 Ų, 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile has 0 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-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile?
The CAS number of 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile is 310457-65-9.
What is the molecular formula of 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile?
The molecular formula of 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile is C17H13Cl2N3O.
What is the molecular weight of 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile?
The molecular weight of 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile is 345.04 g/mol.
Where can I buy 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile?
You can request a quote for 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-[(2,4-Dichlorophenoxy)methyl]benzimidazol-1-yl]propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.