BAS 00398305
TL;DR: BAS 00398305 (CAS 314048-84-5) is a chemical compound with molecular formula C20H11Br2F3N4O and molecular weight 537.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-(2-bromophenyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: BAS 00398305, 3-bromo-N-(2-bromophenyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, N-(2-bromophenyl)[3-bromo-5-phenyl-7-(trifluoromethyl)(8-hydropyrazolo[1,5-a]p yrimidin-2-yl)]carboxamide
| Molecular Formula | C20H11Br2F3N4O |
|---|---|
| Molecular Weight | 537.93 g/mol |
| LogP | 6.1924 |
| Topological Polar Surface Area | 59.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 537.9252 |
| Heavy Atoms | 30 |
| Complexity | 1256.3793 |
Chemical Identifiers
| CAS Number | 314048-84-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC3=C(C(=NN3C(=C2)C(F)(F)F)C(=O)NC4=CC=CC=C4Br)Br |
Product Overview
BAS 00398305 (CAS 314048-84-5), with molecular formula C20H11Br2F3N4O and molecular weight 537.93 g/mol. IUPAC: 3-bromo-N-(2-bromophenyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of BAS 00398305
Property Insights of BAS 00398305
The XLogP value of 6.1924 indicates that BAS 00398305 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.29 Ų, BAS 00398305 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00398305 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00398305?
The CAS number of BAS 00398305 is 314048-84-5.
What is the molecular formula of BAS 00398305?
The molecular formula of BAS 00398305 is C20H11Br2F3N4O.
What is the molecular weight of BAS 00398305?
The molecular weight of BAS 00398305 is 537.93 g/mol.
Where can I buy BAS 00398305?
You can request a quote for BAS 00398305 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00398305?
Yes, KEHONG BIO provides custom synthesis services for BAS 00398305 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.