![[5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate structure](/static/products/3387/338776-99-1.webp)
[5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate
TL;DR: [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate (CAS 338776-99-1) is a chemical compound with molecular formula C18H14ClNO3 and molecular weight 327.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(4-chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate
Also Known As: [5-(4-chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate, 5N-605S, [5-(4-chlorophenyl)-3-isoxazolyl]methyl 4-methylbenzenecarboxylate, F2496-0274, [5-(p-chlorophenyl)-3-isoxazolyl]methyl p-toluate
| Molecular Formula | C18H14ClNO3 |
|---|---|
| Molecular Weight | 327.07 g/mol |
| LogP | 4.66042 |
| Topological Polar Surface Area | 52.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.06622 |
| Heavy Atoms | 23 |
| Complexity | 807.0429 |
Chemical Identifiers
| CAS Number | 338776-99-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)OCC2=NOC(=C2)C3=CC=C(C=C3)Cl |
Product Overview
[5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate (CAS 338776-99-1), with molecular formula C18H14ClNO3 and molecular weight 327.07 g/mol. IUPAC: [5-(4-chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate.
Chemical Property Profile of [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate
Property Insights of [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate
The XLogP value of 4.66042 indicates that [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.33 Ų, [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate has 0 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 [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate?
The CAS number of [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate is 338776-99-1.
What is the molecular formula of [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate?
The molecular formula of [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate is C18H14ClNO3.
What is the molecular weight of [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate?
The molecular weight of [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate is 327.07 g/mol.
Where can I buy [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate?
You can request a quote for [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [5-(4-Chlorophenyl)-1,2-oxazol-3-yl]methyl 4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.