N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide
TL;DR: N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide (CAS 478262-55-4) is a chemical compound with molecular formula C11H8ClFN2O2 and molecular weight 254.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-4-fluorobenzamide
Also Known As: N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide, 9M-032, N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-4-fluorobenzamide
| Molecular Formula | C11H8ClFN2O2 |
|---|---|
| Molecular Weight | 254.03 g/mol |
| LogP | 3.02782 |
| Topological Polar Surface Area | 55.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.02583 |
| Heavy Atoms | 17 |
| Complexity | 551.0991 |
Chemical Identifiers
| CAS Number | 478262-55-4 |
|---|---|
| SMILES | CC1=NOC(=C1Cl)NC(=O)C2=CC=C(C=C2)F |
Product Overview
N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide (CAS 478262-55-4), with molecular formula C11H8ClFN2O2 and molecular weight 254.03 g/mol. IUPAC: N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-4-fluorobenzamide.
Chemical Property Profile of N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide
Property Insights of N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide
The XLogP value of 3.02782 indicates that N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.13 Ų, N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide 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-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide?
The CAS number of N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide is 478262-55-4.
What is the molecular formula of N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide?
The molecular formula of N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide is C11H8ClFN2O2.
What is the molecular weight of N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide?
The molecular weight of N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide is 254.03 g/mol.
Where can I buy N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide?
You can request a quote for N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-chloro-3-methyl-5-isoxazolyl)-4-fluorobenzenecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.