![3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline structure](/static/products/4048/404836-52-8.webp)
3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline
TL;DR: 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline (CAS 404836-52-8) is a chemical compound with molecular formula C12H9N3O2 and molecular weight 227.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline
Also Known As: ChemDiv2_000975, 3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline, BAS 01355288, VU0060908-1, 3-(5-Furan-2-yl-[1,3,4]oxadiazol-2-yl)-phenylamine
| Molecular Formula | C12H9N3O2 |
|---|---|
| Molecular Weight | 227.07 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.06947 |
| Heavy Atoms | 17 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 404836-52-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N)C2=NN=C(O2)C3=CC=CO3 |
| InChIKey | YGVQXBVZASITCA-UHFFFAOYSA-N |
Product Overview
3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline (CAS 404836-52-8), with molecular formula C12H9N3O2 and molecular weight 227.07 g/mol. IUPAC: 3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline.
Chemical Property Profile of 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline
Property Insights of 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline. Following Lipinski's Rule of Five, 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline 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 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline?
The CAS number of 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline is 404836-52-8.
What is the molecular formula of 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline?
The molecular formula of 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline is C12H9N3O2.
What is the molecular weight of 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline?
The molecular weight of 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline is 227.07 g/mol.
Where can I buy 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline?
You can request a quote for 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline?
Yes, KEHONG BIO provides custom synthesis services for 3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.