A3846/0163333
TL;DR: A3846/0163333 (CAS 728015-91-6) is a chemical compound with molecular formula C19H16F3N3O4 and molecular weight 407.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,4-dimethoxyphenyl)methyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Also Known As: A3846/0163333, N-(3,4-dimethoxybenzyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide, N-(3,4-dimethoxybenzyl)-3-(4-(trifluoromethyl)phenyl)-1,2,4-oxadiazole-5-carboxamide, N-[(3,4-dimethoxyphenyl)methyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
| Molecular Formula | C19H16F3N3O4 |
|---|---|
| Molecular Weight | 407.11 g/mol |
| LogP | 3.7026 |
| Topological Polar Surface Area | 86.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 407.10928 |
| Heavy Atoms | 29 |
| Complexity | 1000.67914 |
Chemical Identifiers
| CAS Number | 728015-91-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CNC(=O)C2=NC(=NO2)C3=CC=C(C=C3)C(F)(F)F)OC |
Product Overview
A3846/0163333 (CAS 728015-91-6), with molecular formula C19H16F3N3O4 and molecular weight 407.11 g/mol. IUPAC: N-[(3,4-dimethoxyphenyl)methyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide.
Chemical Property Profile of A3846/0163333
Property Insights of A3846/0163333
The XLogP value of 3.7026 indicates that A3846/0163333 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.48 Ų falls within the moderate polarity range, balancing permeability and solubility for A3846/0163333. Following Lipinski's Rule of Five, A3846/0163333 has 1 hydrogen bond donor(s) and 6 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 A3846/0163333?
The CAS number of A3846/0163333 is 728015-91-6.
What is the molecular formula of A3846/0163333?
The molecular formula of A3846/0163333 is C19H16F3N3O4.
What is the molecular weight of A3846/0163333?
The molecular weight of A3846/0163333 is 407.11 g/mol.
Where can I buy A3846/0163333?
You can request a quote for A3846/0163333 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3846/0163333?
Yes, KEHONG BIO provides custom synthesis services for A3846/0163333 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.