![4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline structure](/static/products/892/892671-87-3.png)
4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline
TL;DR: 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline (CAS 892671-87-3) is a chemical compound with molecular formula C15H13N3O and molecular weight 251.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]aniline
Also Known As: 4-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]aniline
| Molecular Formula | C15H13N3O |
|---|---|
| Molecular Weight | 251.11 g/mol |
| LogP | 3.29422 |
| Topological Polar Surface Area | 64.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.10587 |
| Heavy Atoms | 19 |
| Complexity | 701.4198 |
Chemical Identifiers
| CAS Number | 892671-87-3 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=NN=C(O2)C3=CC=C(C=C3)N |
Product Overview
4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline (CAS 892671-87-3), with molecular formula C15H13N3O and molecular weight 251.11 g/mol. IUPAC: 4-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]aniline.
Chemical Property Profile of 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline
Property Insights of 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline
The XLogP value of 3.29422 indicates that 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline. Following Lipinski's Rule of Five, 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline has 1 hydrogen bond donor(s) and 4 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 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline?
The CAS number of 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline is 892671-87-3.
What is the molecular formula of 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline?
The molecular formula of 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline is C15H13N3O.
What is the molecular weight of 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline?
The molecular weight of 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline is 251.11 g/mol.
Where can I buy 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline?
You can request a quote for 4-[5-(2-Methylphenyl)-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 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-[5-(2-Methylphenyl)-1,3,4-oxadiazol-2-yl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.