(p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile
TL;DR: (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile (CAS 392248-39-4) is a chemical compound with molecular formula C23H17N3O and molecular weight 351.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-yl)-3-(4-benzylphenyl)-3-hydroxyprop-2-enenitrile
Also Known As: F0336-0104, (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile, 3-(4-benzylphenyl)-2-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-3-oxopropanenitrile
| Molecular Formula | C23H17N3O |
|---|---|
| Molecular Weight | 351.14 g/mol |
| LogP | 5.10358 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 351.13718 |
| Heavy Atoms | 27 |
| Complexity | 1116.6854 |
Chemical Identifiers
| CAS Number | 392248-39-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=CC=C(C=C2)C(=C(C#N)C3=NC4=CC=CC=C4N3)O |
Product Overview
(p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile (CAS 392248-39-4), with molecular formula C23H17N3O and molecular weight 351.14 g/mol. IUPAC: 2-(1H-benzimidazol-2-yl)-3-(4-benzylphenyl)-3-hydroxyprop-2-enenitrile.
Chemical Property Profile of (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile
Property Insights of (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile
The XLogP value of 5.10358 indicates that (p-benzylbenzoyl)(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 (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile. Following Lipinski's Rule of Five, (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile?
The CAS number of (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile is 392248-39-4.
What is the molecular formula of (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile?
The molecular formula of (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile is C23H17N3O.
What is the molecular weight of (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile?
The molecular weight of (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile is 351.14 g/mol.
Where can I buy (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile?
You can request a quote for (p-benzylbenzoyl)(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 (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for (p-benzylbenzoyl)(1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.