N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide
TL;DR: N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide (CAS 872613-65-5) is a chemical compound with molecular formula C19H17N3O4S and molecular weight 383.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]benzamide
Also Known As: N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide, N-[(5-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]benzamide, N-[[5-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]benzamide, N-({5-[(p-anisoyl)methylthio]-1,3,4-oxadiazol-2-yl}methyl)benzamide
| Molecular Formula | C19H17N3O4S |
|---|---|
| Molecular Weight | 383.09 g/mol |
| LogP | 2.9832 |
| Topological Polar Surface Area | 94.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 383.09396 |
| Heavy Atoms | 27 |
| Complexity | 910.21893 |
Chemical Identifiers
| CAS Number | 872613-65-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)CSC2=NN=C(O2)CNC(=O)C3=CC=CC=C3 |
Product Overview
N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide (CAS 872613-65-5), with molecular formula C19H17N3O4S and molecular weight 383.09 g/mol. IUPAC: N-[[5-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]benzamide.
Chemical Property Profile of N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide
Property Insights of N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide
The XLogP value of 2.9832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide. The TPSA of 94.32 Ų falls within the moderate polarity range, balancing permeability and solubility for N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide. Following Lipinski's Rule of Five, N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide has 1 hydrogen bond donor(s) and 7 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-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide?
The CAS number of N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide is 872613-65-5.
What is the molecular formula of N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide?
The molecular formula of N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide is C19H17N3O4S.
What is the molecular weight of N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide?
The molecular weight of N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide is 383.09 g/mol.
Where can I buy N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide?
You can request a quote for N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-((5-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.