A3800/0161275
TL;DR: A3800/0161275 (CAS 727685-71-4) is a chemical compound with molecular formula C20H15F3N4O2 and molecular weight 400.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(1H-indol-3-yl)ethyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Also Known As: A3800/0161275, N-[2-(1H-indol-3-yl)ethyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide, N-(2-(1H-indol-3-yl)ethyl)-3-(4-(trifluoromethyl)phenyl)-1,2,4-oxadiazole-5-carboxamide
| Molecular Formula | C20H15F3N4O2 |
|---|---|
| Molecular Weight | 400.11 g/mol |
| LogP | 4.2092 |
| Topological Polar Surface Area | 83.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 400.11472 |
| Heavy Atoms | 29 |
| Complexity | 1146.4653 |
Chemical Identifiers
| CAS Number | 727685-71-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C3=NC(=NO3)C4=CC=C(C=C4)C(F)(F)F |
Product Overview
A3800/0161275 (CAS 727685-71-4), with molecular formula C20H15F3N4O2 and molecular weight 400.11 g/mol. IUPAC: N-[2-(1H-indol-3-yl)ethyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide.
Chemical Property Profile of A3800/0161275
Property Insights of A3800/0161275
The XLogP value of 4.2092 indicates that A3800/0161275 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.81 Ų falls within the moderate polarity range, balancing permeability and solubility for A3800/0161275. Following Lipinski's Rule of Five, A3800/0161275 has 2 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 A3800/0161275?
The CAS number of A3800/0161275 is 727685-71-4.
What is the molecular formula of A3800/0161275?
The molecular formula of A3800/0161275 is C20H15F3N4O2.
What is the molecular weight of A3800/0161275?
The molecular weight of A3800/0161275 is 400.11 g/mol.
Where can I buy A3800/0161275?
You can request a quote for A3800/0161275 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3800/0161275?
Yes, KEHONG BIO provides custom synthesis services for A3800/0161275 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.