N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide
TL;DR: N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide (CAS 697231-81-5) is a chemical compound with molecular formula C15H13N3O2S and molecular weight 299.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-phenylethyl)-3-thiophen-2-yl-1,2,4-oxadiazole-5-carboxamide
Also Known As: N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide, A3619/0153469, N-phenethyl-3-(thiophen-2-yl)-1,2,4-oxadiazole-5-carboxamide, N-phenethyl-3-thiophen-2-yl-1,2,4-oxadiazole-5-carboxamide, N-(2-phenylethyl)-3-thiophen-2-yl-1,2,4-oxadiazole-5-carboxamide
| Molecular Formula | C15H13N3O2S |
|---|---|
| Molecular Weight | 299.07 g/mol |
| LogP | 2.7706 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 299.07285 |
| Heavy Atoms | 21 |
| Complexity | 707.6211 |
Chemical Identifiers
| CAS Number | 697231-81-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNC(=O)C2=NC(=NO2)C3=CC=CS3 |
Product Overview
N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide (CAS 697231-81-5), with molecular formula C15H13N3O2S and molecular weight 299.07 g/mol. IUPAC: N-(2-phenylethyl)-3-thiophen-2-yl-1,2,4-oxadiazole-5-carboxamide.
Chemical Property Profile of N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide
Property Insights of N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide
The XLogP value of 2.7706 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide. Following Lipinski's Rule of Five, N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide has 1 hydrogen bond donor(s) and 5 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-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide?
The CAS number of N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide is 697231-81-5.
What is the molecular formula of N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide?
The molecular formula of N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide is C15H13N3O2S.
What is the molecular weight of N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide?
The molecular weight of N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide is 299.07 g/mol.
Where can I buy N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide?
You can request a quote for N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-phenylethyl)-3-(2-thienyl)-1,2,4-oxadiazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.