A3689/0156516
TL;DR: A3689/0156516 (CAS 704876-68-6) is a chemical compound with molecular formula C17H19N5O4 and molecular weight 357.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dimethoxyphenyl)-N-(3-imidazol-1-ylpropyl)-1,2,4-oxadiazole-5-carboxamide
Also Known As: A3689/0156516, 3-(3,4-dimethoxyphenyl)-N-[3-(1H-imidazol-1-yl)propyl]-1,2,4-oxadiazole-5-carboxamide, 3-(3,4-dimethoxyphenyl)-N-(3-imidazol-1-ylpropyl)-1,2,4-oxadiazole-5-carboxamide, N-(3-(1H-imidazol-1-yl)propyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole-5-carboxamide
| Molecular Formula | C17H19N5O4 |
|---|---|
| Molecular Weight | 357.14 g/mol |
| LogP | 1.7704 |
| Topological Polar Surface Area | 104.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 357.1437 |
| Heavy Atoms | 26 |
| Complexity | 859.92773 |
Chemical Identifiers
| CAS Number | 704876-68-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NOC(=N2)C(=O)NCCCN3C=CN=C3)OC |
Product Overview
A3689/0156516 (CAS 704876-68-6), with molecular formula C17H19N5O4 and molecular weight 357.14 g/mol. IUPAC: 3-(3,4-dimethoxyphenyl)-N-(3-imidazol-1-ylpropyl)-1,2,4-oxadiazole-5-carboxamide.
Chemical Property Profile of A3689/0156516
Property Insights of A3689/0156516
The XLogP value of 1.7704 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3689/0156516. The TPSA of 104.3 Ų falls within the moderate polarity range, balancing permeability and solubility for A3689/0156516. Following Lipinski's Rule of Five, A3689/0156516 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 A3689/0156516?
The CAS number of A3689/0156516 is 704876-68-6.
What is the molecular formula of A3689/0156516?
The molecular formula of A3689/0156516 is C17H19N5O4.
What is the molecular weight of A3689/0156516?
The molecular weight of A3689/0156516 is 357.14 g/mol.
Where can I buy A3689/0156516?
You can request a quote for A3689/0156516 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3689/0156516?
Yes, KEHONG BIO provides custom synthesis services for A3689/0156516 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.