BAS 00535056
TL;DR: BAS 00535056 (CAS 353254-01-0) is a chemical compound with molecular formula C23H16F3N5OS and molecular weight 467.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Also Known As: BAS 00535056, BIM-0028163.P001, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide, N-(3-cyano(4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl))[5-phenyl-7-(trifluorometh yl)(8-hydropyrazolo[1,5-a]pyrimidin-3-yl)]carboxamide, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
| Molecular Formula | C23H16F3N5OS |
|---|---|
| Molecular Weight | 467.10 g/mol |
| LogP | 5.47938 |
| Topological Polar Surface Area | 83.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 467.10275 |
| Heavy Atoms | 33 |
| Complexity | 1416.129 |
Chemical Identifiers
| CAS Number | 353254-01-0 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=C4N=C(C=C(N4N=C3)C(F)(F)F)C5=CC=CC=C5)C#N |
Product Overview
BAS 00535056 (CAS 353254-01-0), with molecular formula C23H16F3N5OS and molecular weight 467.10 g/mol. IUPAC: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
Chemical Property Profile of BAS 00535056
Property Insights of BAS 00535056
The XLogP value of 5.47938 indicates that BAS 00535056 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00535056. Following Lipinski's Rule of Five, BAS 00535056 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 00535056?
The CAS number of BAS 00535056 is 353254-01-0.
What is the molecular formula of BAS 00535056?
The molecular formula of BAS 00535056 is C23H16F3N5OS.
What is the molecular weight of BAS 00535056?
The molecular weight of BAS 00535056 is 467.10 g/mol.
Where can I buy BAS 00535056?
You can request a quote for BAS 00535056 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00535056?
Yes, KEHONG BIO provides custom synthesis services for BAS 00535056 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.