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N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide
TL;DR: N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide (CAS 337931-53-0) is a chemical compound with molecular formula C14H11FN4O and molecular weight 270.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide
Also Known As: BAS 01409661, N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide, N-[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]acetamide, AB00101918-01, AP-970/13396168
| Molecular Formula | C14H11FN4O |
|---|---|
| Molecular Weight | 270.09 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 59.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.09167 |
| Heavy Atoms | 20 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 337931-53-0 |
|---|---|
| SMILES | CC(=O)NC1=CC2=NN(N=C2C=C1)C3=CC=C(C=C3)F |
| InChIKey | RHBNKOGLTLAGBW-UHFFFAOYSA-N |
Product Overview
N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide (CAS 337931-53-0), with molecular formula C14H11FN4O and molecular weight 270.09 g/mol. IUPAC: N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide.
Chemical Property Profile of N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide
Property Insights of N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide. With a topological polar surface area (TPSA) of 59.8 Ų, N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide has 1 hydrogen bond donor(s) and 4 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-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide?
The CAS number of N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide is 337931-53-0.
What is the molecular formula of N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide?
The molecular formula of N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide is C14H11FN4O.
What is the molecular weight of N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide?
The molecular weight of N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide is 270.09 g/mol.
Where can I buy N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide?
You can request a quote for N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.