BAS 01840996
TL;DR: BAS 01840996 (CAS 332852-12-7) is a chemical compound with molecular formula C18H14BrF3N4OS and molecular weight 470.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-5-thiophen-2-yl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: BAS 01840996, N-(4-bromophenyl)-5-(thiophen-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide, N-(4-Bromophenyl)-5-thiophen-2-yl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide, N-(4-bromophenyl)-5-(2-thienyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide, N-(4-bromophenyl)-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
| Molecular Formula | C18H14BrF3N4OS |
|---|---|
| Molecular Weight | 470.00 g/mol |
| LogP | 5.6197 |
| Topological Polar Surface Area | 58.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 470.00238 |
| Heavy Atoms | 28 |
| Complexity | 985.43195 |
Chemical Identifiers
| CAS Number | 332852-12-7 |
|---|---|
| SMILES | C1C(NC2=CC(=NN2C1C(F)(F)F)C(=O)NC3=CC=C(C=C3)Br)C4=CC=CS4 |
Product Overview
BAS 01840996 (CAS 332852-12-7), with molecular formula C18H14BrF3N4OS and molecular weight 470.00 g/mol. IUPAC: N-(4-bromophenyl)-5-thiophen-2-yl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of BAS 01840996
Property Insights of BAS 01840996
The XLogP value of 5.6197 indicates that BAS 01840996 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.95 Ų, BAS 01840996 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01840996 has 2 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 01840996?
The CAS number of BAS 01840996 is 332852-12-7.
What is the molecular formula of BAS 01840996?
The molecular formula of BAS 01840996 is C18H14BrF3N4OS.
What is the molecular weight of BAS 01840996?
The molecular weight of BAS 01840996 is 470.00 g/mol.
Where can I buy BAS 01840996?
You can request a quote for BAS 01840996 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01840996?
Yes, KEHONG BIO provides custom synthesis services for BAS 01840996 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.