Bionet1_003864
TL;DR: Bionet1_003864 (CAS 477871-41-3) is a chemical compound with molecular formula C20H18F3N3O and molecular weight 373.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dimethylamino)-1-[1-[[4-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]prop-2-en-1-one
Also Known As: Bionet1_003864, (Z)-3-(dimethylamino)-1-{1-[4-(trifluoromethyl)benzyl]-1H-1,3-benzimidazol-2-yl}-2-propen-1-one, 3-(dimethylamino)-1-[1-[[4-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]prop-2-en-1-one
| Molecular Formula | C20H18F3N3O |
|---|---|
| Molecular Weight | 373.14 g/mol |
| LogP | 4.3614 |
| Topological Polar Surface Area | 38.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.1402 |
| Heavy Atoms | 27 |
| Complexity | 985.86975 |
Chemical Identifiers
| CAS Number | 477871-41-3 |
|---|---|
| SMILES | CN(C)C=CC(=O)C1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)C(F)(F)F |
Product Overview
Bionet1_003864 (CAS 477871-41-3), with molecular formula C20H18F3N3O and molecular weight 373.14 g/mol. IUPAC: 3-(dimethylamino)-1-[1-[[4-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]prop-2-en-1-one.
Chemical Property Profile of Bionet1_003864
Property Insights of Bionet1_003864
The XLogP value of 4.3614 indicates that Bionet1_003864 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.13 Ų, Bionet1_003864 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_003864 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 Bionet1_003864?
The CAS number of Bionet1_003864 is 477871-41-3.
What is the molecular formula of Bionet1_003864?
The molecular formula of Bionet1_003864 is C20H18F3N3O.
What is the molecular weight of Bionet1_003864?
The molecular weight of Bionet1_003864 is 373.14 g/mol.
Where can I buy Bionet1_003864?
You can request a quote for Bionet1_003864 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_003864?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_003864 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.