BAS 02833077
TL;DR: BAS 02833077 (CAS 552820-49-2) is a chemical compound with molecular formula C20H14F3N5OS and molecular weight 429.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide
Also Known As: BAS 02833077, F1874-0053, 2-({1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}sulfanyl)-N-[3-(trifluoromethyl)phenyl]acetamide, 2-((1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)thio)-N-(3-(trifluoromethyl)phenyl)acetamide, 2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide
| Molecular Formula | C20H14F3N5OS |
|---|---|
| Molecular Weight | 429.09 g/mol |
| LogP | 4.5651 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 429.08713 |
| Heavy Atoms | 30 |
| Complexity | 1193.999 |
Chemical Identifiers
| CAS Number | 552820-49-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC(=O)NC4=CC=CC(=C4)C(F)(F)F |
Product Overview
BAS 02833077 (CAS 552820-49-2), with molecular formula C20H14F3N5OS and molecular weight 429.09 g/mol. IUPAC: 2-(1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of BAS 02833077
Property Insights of BAS 02833077
The XLogP value of 4.5651 indicates that BAS 02833077 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02833077. Following Lipinski's Rule of Five, BAS 02833077 has 1 hydrogen bond donor(s) and 5 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 02833077?
The CAS number of BAS 02833077 is 552820-49-2.
What is the molecular formula of BAS 02833077?
The molecular formula of BAS 02833077 is C20H14F3N5OS.
What is the molecular weight of BAS 02833077?
The molecular weight of BAS 02833077 is 429.09 g/mol.
Where can I buy BAS 02833077?
You can request a quote for BAS 02833077 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02833077?
Yes, KEHONG BIO provides custom synthesis services for BAS 02833077 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.