CBKinase1_004277
TL;DR: CBKinase1_004277 (CAS 445245-68-1) is a chemical compound with molecular formula C22H17F2N5O4 and molecular weight 453.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(difluoromethyl)-N-(5-methoxy-2-nitrophenyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Also Known As: CBKinase1_004277, CBKinase1_016677, 7-(difluoromethyl)-N-(5-methoxy-2-nitrophenyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide, BRD-K20952275-001-01-9, 7-(difluoromethyl)-N-{2-nitro-5-methoxyphenyl}-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
| Molecular Formula | C22H17F2N5O4 |
|---|---|
| Molecular Weight | 453.12 g/mol |
| LogP | 4.81142 |
| Topological Polar Surface Area | 111.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 453.12485 |
| Heavy Atoms | 33 |
| Complexity | 1369.4764 |
Chemical Identifiers
| CAS Number | 445245-68-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)C(F)F)C(=O)NC4=C(C=CC(=C4)OC)[N+](=O)[O-] |
Product Overview
CBKinase1_004277 (CAS 445245-68-1), with molecular formula C22H17F2N5O4 and molecular weight 453.12 g/mol. IUPAC: 7-(difluoromethyl)-N-(5-methoxy-2-nitrophenyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
Chemical Property Profile of CBKinase1_004277
Property Insights of CBKinase1_004277
The XLogP value of 4.81142 indicates that CBKinase1_004277 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.66 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004277. Following Lipinski's Rule of Five, CBKinase1_004277 has 1 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 CBKinase1_004277?
The CAS number of CBKinase1_004277 is 445245-68-1.
What is the molecular formula of CBKinase1_004277?
The molecular formula of CBKinase1_004277 is C22H17F2N5O4.
What is the molecular weight of CBKinase1_004277?
The molecular weight of CBKinase1_004277 is 453.12 g/mol.
Where can I buy CBKinase1_004277?
You can request a quote for CBKinase1_004277 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004277?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004277 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.