BAS 00398146
TL;DR: BAS 00398146 (CAS 313986-50-4) is a chemical compound with molecular formula C23H18BrF3N4O2 and molecular weight 518.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-5-(4-methoxyphenyl)-N-(2-phenylethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: BAS 00398146, 3-bromo-5-(4-methoxyphenyl)-N-(2-phenylethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, 3-bromo-5-(4-methoxyphenyl)-N-phenethyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
| Molecular Formula | C23H18BrF3N4O2 |
|---|---|
| Molecular Weight | 518.06 g/mol |
| LogP | 5.1587 |
| Topological Polar Surface Area | 68.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 518.0565 |
| Heavy Atoms | 33 |
| Complexity | 1289.3032 |
Chemical Identifiers
| CAS Number | 313986-50-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NC3=C(C(=NN3C(=C2)C(F)(F)F)C(=O)NCCC4=CC=CC=C4)Br |
Product Overview
BAS 00398146 (CAS 313986-50-4), with molecular formula C23H18BrF3N4O2 and molecular weight 518.06 g/mol. IUPAC: 3-bromo-5-(4-methoxyphenyl)-N-(2-phenylethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of BAS 00398146
Property Insights of BAS 00398146
The XLogP value of 5.1587 indicates that BAS 00398146 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.52 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00398146. Following Lipinski's Rule of Five, BAS 00398146 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00398146?
The CAS number of BAS 00398146 is 313986-50-4.
What is the molecular formula of BAS 00398146?
The molecular formula of BAS 00398146 is C23H18BrF3N4O2.
What is the molecular weight of BAS 00398146?
The molecular weight of BAS 00398146 is 518.06 g/mol.
Where can I buy BAS 00398146?
You can request a quote for BAS 00398146 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00398146?
Yes, KEHONG BIO provides custom synthesis services for BAS 00398146 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.