BAS 00398055
TL;DR: BAS 00398055 (CAS 353499-58-8) is a chemical compound with molecular formula C24H17BrF4N4O3 and molecular weight 564.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-[3-(4-fluorophenoxy)-5-pyridin-3-yloxyphenyl]acetamide
Also Known As: BAS 00398055, 2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-[3-(4-fluorophenoxy)-5-pyridin-3-yloxyphenyl]acetamide, 2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-[3-(4-fluorophenoxy)-5-(3-pyridinyloxy)phenyl]acetamide, 2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-[3-(4-fluorophenoxy)-5-(pyridin-3-yloxy)phenyl]acetamide, 2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazolyl]-N-[3-(4-fluorophenoxy)-5-(3- pyridyloxy)phenyl]acetamide
| Molecular Formula | C24H17BrF4N4O3 |
|---|---|
| Molecular Weight | 564.04 g/mol |
| LogP | 6.73022 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 564.042 |
| Heavy Atoms | 36 |
| Complexity | 1376.8748 |
Chemical Identifiers
| CAS Number | 353499-58-8 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)NC2=CC(=CC(=C2)OC3=CN=CC=C3)OC4=CC=C(C=C4)F)C(F)(F)F)Br |
Product Overview
BAS 00398055 (CAS 353499-58-8), with molecular formula C24H17BrF4N4O3 and molecular weight 564.04 g/mol. IUPAC: 2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-[3-(4-fluorophenoxy)-5-pyridin-3-yloxyphenyl]acetamide.
Chemical Property Profile of BAS 00398055
Property Insights of BAS 00398055
The XLogP value of 6.73022 indicates that BAS 00398055 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.27 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00398055. Following Lipinski's Rule of Five, BAS 00398055 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00398055?
The CAS number of BAS 00398055 is 353499-58-8.
What is the molecular formula of BAS 00398055?
The molecular formula of BAS 00398055 is C24H17BrF4N4O3.
What is the molecular weight of BAS 00398055?
The molecular weight of BAS 00398055 is 564.04 g/mol.
Where can I buy BAS 00398055?
You can request a quote for BAS 00398055 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00398055?
Yes, KEHONG BIO provides custom synthesis services for BAS 00398055 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.