BAS 00414866
TL;DR: BAS 00414866 (CAS 355416-53-4) is a chemical compound with molecular formula C10H13BrF3N3O2 and molecular weight 343.01 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-(2-methoxyethyl)acetamide
Also Known As: BAS 00414866, 2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(2-methoxyethyl)acetamide, BRD-K19019792-001-08-9, 2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-methoxyethyl)acetamide, 2-(4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)-N-(2-methoxyethyl)acetamide
| Molecular Formula | C10H13BrF3N3O2 |
|---|---|
| Molecular Weight | 343.01 g/mol |
| LogP | 1.73542 |
| Topological Polar Surface Area | 56.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.0143 |
| Heavy Atoms | 19 |
| Complexity | 459.60773 |
Chemical Identifiers
| CAS Number | 355416-53-4 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)NCCOC)C(F)(F)F)Br |
Product Overview
BAS 00414866 (CAS 355416-53-4), with molecular formula C10H13BrF3N3O2 and molecular weight 343.01 g/mol. IUPAC: 2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-methoxyethyl)acetamide.
Chemical Property Profile of BAS 00414866
Property Insights of BAS 00414866
The XLogP value of 1.73542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00414866. With a topological polar surface area (TPSA) of 56.15 Ų, BAS 00414866 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00414866 has 1 hydrogen bond donor(s) and 3 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 BAS 00414866?
The CAS number of BAS 00414866 is 355416-53-4.
What is the molecular formula of BAS 00414866?
The molecular formula of BAS 00414866 is C10H13BrF3N3O2.
What is the molecular weight of BAS 00414866?
The molecular weight of BAS 00414866 is 343.01 g/mol.
Where can I buy BAS 00414866?
You can request a quote for BAS 00414866 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00414866?
Yes, KEHONG BIO provides custom synthesis services for BAS 00414866 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.