CBKinase1_000435
TL;DR: CBKinase1_000435 (CAS 313986-51-5) is a chemical compound with molecular formula C21H21BrF3N5O3 and molecular weight 527.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-5-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: CBKinase1_000435, CBKinase1_012835, BAS 00398149, BRD-K68655069-001-01-1, 3-bromo-5-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
| Molecular Formula | C21H21BrF3N5O3 |
|---|---|
| Molecular Weight | 527.08 g/mol |
| LogP | 3.2482 |
| Topological Polar Surface Area | 80.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 527.078 |
| Heavy Atoms | 33 |
| Complexity | 1144.7382 |
Chemical Identifiers
| CAS Number | 313986-51-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NC3=C(C(=NN3C(=C2)C(F)(F)F)C(=O)NCCN4CCOCC4)Br |
Product Overview
CBKinase1_000435 (CAS 313986-51-5), with molecular formula C21H21BrF3N5O3 and molecular weight 527.08 g/mol. IUPAC: 3-bromo-5-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of CBKinase1_000435
Property Insights of CBKinase1_000435
The XLogP value of 3.2482 indicates that CBKinase1_000435 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.99 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_000435. Following Lipinski's Rule of Five, CBKinase1_000435 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_000435?
The CAS number of CBKinase1_000435 is 313986-51-5.
What is the molecular formula of CBKinase1_000435?
The molecular formula of CBKinase1_000435 is C21H21BrF3N5O3.
What is the molecular weight of CBKinase1_000435?
The molecular weight of CBKinase1_000435 is 527.08 g/mol.
Where can I buy CBKinase1_000435?
You can request a quote for CBKinase1_000435 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_000435?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_000435 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.