1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole
TL;DR: 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole (CAS 637325-08-7) is a chemical compound with molecular formula C16H15FN2 and molecular weight 254.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-fluorophenyl)methyl]-5,6-dimethylbenzimidazole
Also Known As: 1-(4-fluorobenzyl)-5,6-dimethyl-1H-benzimidazole, 1-[(4-fluorophenyl)methyl]-5,6-dimethyl-1H-1,3-benzodiazole, 1-[(4-fluorophenyl)methyl]-5,6-dimethylbenzimidazole, BAS 07327755, 1-(3'-fluoro)benzyl-5,6-dimethylbenzimidazole
| Molecular Formula | C16H15FN2 |
|---|---|
| Molecular Weight | 254.12 g/mol |
| LogP | 3.84054 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.12193 |
| Heavy Atoms | 19 |
| Complexity | 726.3388 |
Chemical Identifiers
| CAS Number | 637325-08-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N(C=N2)CC3=CC=C(C=C3)F |
Product Overview
1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole (CAS 637325-08-7), with molecular formula C16H15FN2 and molecular weight 254.12 g/mol. IUPAC: 1-[(4-fluorophenyl)methyl]-5,6-dimethylbenzimidazole.
Chemical Property Profile of 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole
Property Insights of 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole
The XLogP value of 3.84054 indicates that 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole has 0 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-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole?
The CAS number of 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole is 637325-08-7.
What is the molecular formula of 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole?
The molecular formula of 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole is C16H15FN2.
What is the molecular weight of 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole?
The molecular weight of 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole is 254.12 g/mol.
Where can I buy 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole?
You can request a quote for 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole?
Yes, KEHONG BIO provides custom synthesis services for 1-((4-fluorophenyl)methyl)-5,6-dimethyl-1H-1,3-benzodiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.