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Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate
TL;DR: Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate (CAS 5471-21-6) is a chemical compound with molecular formula C15H18N2O3S and molecular weight 306.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl 2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate
Also Known As: pentyl2-[ sulfanyl]acetate, BAS 00442074, BIM-0020894.P001, pentyl 2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate, Hexanedioic acid,2-(hydroxyimino)-3-oxo-, 1-methyl ester
| Molecular Formula | C15H18N2O3S |
|---|---|
| Molecular Weight | 306.10 g/mol |
| LogP | 3.5621 |
| Topological Polar Surface Area | 65.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 306.10382 |
| Heavy Atoms | 21 |
| Complexity | 557.0562 |
Chemical Identifiers
| CAS Number | 5471-21-6 |
|---|---|
| SMILES | CCCCCOC(=O)CSC1=NN=C(O1)C2=CC=CC=C2 |
Product Overview
Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate (CAS 5471-21-6), with molecular formula C15H18N2O3S and molecular weight 306.10 g/mol. IUPAC: pentyl 2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate.
Chemical Property Profile of Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate
Property Insights of Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate
The XLogP value of 3.5621 indicates that Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate. Following Lipinski's Rule of Five, Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate has 0 hydrogen bond donor(s) and 6 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 Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate?
The CAS number of Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate is 5471-21-6.
What is the molecular formula of Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate?
The molecular formula of Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate is C15H18N2O3S.
What is the molecular weight of Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate?
The molecular weight of Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate is 306.10 g/mol.
Where can I buy Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate?
You can request a quote for Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.