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N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline
TL;DR: N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline (CAS 364610-24-2) is a chemical compound with molecular formula C21H18FN3 and molecular weight 331.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline
Also Known As: N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline, N-[(1-benzyl-1H-benzimidazol-2-yl)methyl]-4-fluoroaniline, N-((1-benzyl-1H-benzo[d]imidazol-2-yl)methyl)-4-fluoroaniline
| Molecular Formula | C21H18FN3 |
|---|---|
| Molecular Weight | 331.15 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 29.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.14847 |
| Heavy Atoms | 25 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 364610-24-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2CNC4=CC=C(C=C4)F |
| InChIKey | PHSXTHBFQRKTHO-UHFFFAOYSA-N |
Product Overview
N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline (CAS 364610-24-2), with molecular formula C21H18FN3 and molecular weight 331.15 g/mol. IUPAC: N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline.
Chemical Property Profile of N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline
Property Insights of N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline
The XLogP value of 4.6 indicates that N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.9 Ų, N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline has 1 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 N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline?
The CAS number of N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline is 364610-24-2.
What is the molecular formula of N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline?
The molecular formula of N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline is C21H18FN3.
What is the molecular weight of N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline?
The molecular weight of N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline is 331.15 g/mol.
Where can I buy N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline?
You can request a quote for N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[(1-benzylbenzimidazol-2-yl)methyl]-4-fluoroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.