ChemDiv1_012388
TL;DR: ChemDiv1_012388 (CAS 388114-67-8) is a chemical compound with molecular formula C21H16F3N5O3S and molecular weight 475.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
furan-2-yl-[4-[5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]piperazin-1-yl]methanone
Also Known As: ChemDiv1_012388, F0406-2236, furan-2-yl-[4-[5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]piperazin-1-yl]methanone, (4-(furan-2-carbonyl)piperazin-1-yl)(5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl)methanone, 1-(furan-2-carbonyl)-4-[5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]piperazine
| Molecular Formula | C21H16F3N5O3S |
|---|---|
| Molecular Weight | 475.09 g/mol |
| LogP | 3.6678 |
| Topological Polar Surface Area | 83.95 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 475.0926 |
| Heavy Atoms | 33 |
| Complexity | 1307.1251 |
Chemical Identifiers
| CAS Number | 388114-67-8 |
|---|---|
| SMILES | C1CN(CCN1C(=O)C2=CC=CO2)C(=O)C3=NN4C(=CC(=NC4=C3)C5=CC=CS5)C(F)(F)F |
Product Overview
ChemDiv1_012388 (CAS 388114-67-8), with molecular formula C21H16F3N5O3S and molecular weight 475.09 g/mol. IUPAC: furan-2-yl-[4-[5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]piperazin-1-yl]methanone.
Chemical Property Profile of ChemDiv1_012388
Property Insights of ChemDiv1_012388
The XLogP value of 3.6678 indicates that ChemDiv1_012388 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.95 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_012388. Following Lipinski's Rule of Five, ChemDiv1_012388 has 0 hydrogen bond donor(s) and 6 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 ChemDiv1_012388?
The CAS number of ChemDiv1_012388 is 388114-67-8.
What is the molecular formula of ChemDiv1_012388?
The molecular formula of ChemDiv1_012388 is C21H16F3N5O3S.
What is the molecular weight of ChemDiv1_012388?
The molecular weight of ChemDiv1_012388 is 475.09 g/mol.
Where can I buy ChemDiv1_012388?
You can request a quote for ChemDiv1_012388 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_012388?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_012388 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.