CBKinase1_011986
TL;DR: CBKinase1_011986 (CAS 489450-06-8) is a chemical compound with molecular formula C21H22BrF3N6O and molecular weight 510.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-bromophenyl)-7-(trifluoromethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Also Known As: CBKinase1_011986, CBKinase1_024386, BRD-A61124869-001-01-9, 5-(4-bromophenyl)-7-(trifluoromethyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide, 5-(4-bromophenyl)-7-(trifluoromethyl)-N-((1,3,5-trimethyl-1H-pyrazol-4-yl)methyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
| Molecular Formula | C21H22BrF3N6O |
|---|---|
| Molecular Weight | 510.10 g/mol |
| LogP | 4.58624 |
| Topological Polar Surface Area | 76.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 510.09906 |
| Heavy Atoms | 32 |
| Complexity | 1151.7345 |
Chemical Identifiers
| CAS Number | 489450-06-8 |
|---|---|
| SMILES | CC1=C(C(=NN1C)C)CNC(=O)C2=C3NC(CC(N3N=C2)C(F)(F)F)C4=CC=C(C=C4)Br |
Product Overview
CBKinase1_011986 (CAS 489450-06-8), with molecular formula C21H22BrF3N6O and molecular weight 510.10 g/mol. IUPAC: 5-(4-bromophenyl)-7-(trifluoromethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide.
Chemical Property Profile of CBKinase1_011986
Property Insights of CBKinase1_011986
The XLogP value of 4.58624 indicates that CBKinase1_011986 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.77 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_011986. Following Lipinski's Rule of Five, CBKinase1_011986 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 CBKinase1_011986?
The CAS number of CBKinase1_011986 is 489450-06-8.
What is the molecular formula of CBKinase1_011986?
The molecular formula of CBKinase1_011986 is C21H22BrF3N6O.
What is the molecular weight of CBKinase1_011986?
The molecular weight of CBKinase1_011986 is 510.10 g/mol.
Where can I buy CBKinase1_011986?
You can request a quote for CBKinase1_011986 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_011986?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_011986 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.