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1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one
TL;DR: 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one (CAS 161469-01-8) is a chemical compound with molecular formula C15H11F3N2O and molecular weight 292.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-6-(trifluoromethyl)-1H-benzimidazol-2-one
Also Known As: 1-benzyl-5-(trifluoromethyl)-2,3-dihydro-1H-1,3-benzodiazol-2-one, 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one, 3-benzyl-6-(trifluoromethyl)-1H-benzimidazol-2-one, 1-Benzyl-5-(trifluoromethyl)-1H-benzimidazol-2(3H)-one, 2H-Benzimidazol-2-one,1,3-dihydro-1-(phenylmethyl)-5-(trifluoromethyl)-
| Molecular Formula | C15H11F3N2O |
|---|---|
| Molecular Weight | 292.08 g/mol |
| LogP | 3.3967 |
| Topological Polar Surface Area | 37.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.08234 |
| Heavy Atoms | 21 |
| Complexity | 831.48627 |
Chemical Identifiers
| CAS Number | 161469-01-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)C(F)(F)F)NC2=O |
Product Overview
1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one (CAS 161469-01-8), with molecular formula C15H11F3N2O and molecular weight 292.08 g/mol. IUPAC: 3-benzyl-6-(trifluoromethyl)-1H-benzimidazol-2-one.
Chemical Property Profile of 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one
Property Insights of 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one
The XLogP value of 3.3967 indicates that 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.79 Ų, 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one has 1 hydrogen bond donor(s) and 1 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 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one?
The CAS number of 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one is 161469-01-8.
What is the molecular formula of 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one?
The molecular formula of 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one is C15H11F3N2O.
What is the molecular weight of 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one?
The molecular weight of 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one is 292.08 g/mol.
Where can I buy 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one?
You can request a quote for 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-benzyl-5-(trifluoromethyl)-1H-benzo[d]imidazol-2(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.