N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide
TL;DR: N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide (CAS 876893-96-8) is a chemical compound with molecular formula C15H17N3O5 and molecular weight 319.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-oxobutanamide
Also Known As: BAS 12239578, N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide, N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-oxobutanamide, N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-oxobutanamide, N-[3-(3,4-Dimethoxy-phenyl)-[1,2,4]oxadiazol-5-ylmethyl]-3-oxo-butyramide
| Molecular Formula | C15H17N3O5 |
|---|---|
| Molecular Weight | 319.12 g/mol |
| LogP | 1.3491 |
| Topological Polar Surface Area | 103.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 319.11682 |
| Heavy Atoms | 23 |
| Complexity | 710.88794 |
Chemical Identifiers
| CAS Number | 876893-96-8 |
|---|---|
| SMILES | CC(=O)CC(=O)NCC1=NC(=NO1)C2=CC(=C(C=C2)OC)OC |
Product Overview
N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide (CAS 876893-96-8), with molecular formula C15H17N3O5 and molecular weight 319.12 g/mol. IUPAC: N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-oxobutanamide.
Chemical Property Profile of N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide
Property Insights of N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide
The XLogP value of 1.3491 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide. The TPSA of 103.55 Ų falls within the moderate polarity range, balancing permeability and solubility for N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide. Following Lipinski's Rule of Five, N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide 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-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide?
The CAS number of N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide is 876893-96-8.
What is the molecular formula of N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide?
The molecular formula of N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide is C15H17N3O5.
What is the molecular weight of N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide?
The molecular weight of N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide is 319.12 g/mol.
Where can I buy N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide?
You can request a quote for N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-3-oxobutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.