CBKinase1_004334
TL;DR: CBKinase1_004334 (CAS 664984-97-8) is a chemical compound with molecular formula C21H14ClF2N5O2 and molecular weight 441.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-benzoyl-4-chlorophenyl)-7-(difluoromethyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: CBKinase1_004334, CBKinase1_016734, BRD-K12937542-001-01-7, N-(2-benzoyl-4-chlorophenyl)-7-(difluoromethyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide, N-(2-benzoyl-4-chlorophenyl)-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
| Molecular Formula | C21H14ClF2N5O2 |
|---|---|
| Molecular Weight | 441.08 g/mol |
| LogP | 4.50702 |
| Topological Polar Surface Area | 89.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 441.0804 |
| Heavy Atoms | 31 |
| Complexity | 1308.1266 |
Chemical Identifiers
| CAS Number | 664984-97-8 |
|---|---|
| SMILES | CC1=NC2=NC(=NN2C(=C1)C(F)F)C(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4 |
Product Overview
CBKinase1_004334 (CAS 664984-97-8), with molecular formula C21H14ClF2N5O2 and molecular weight 441.08 g/mol. IUPAC: N-(2-benzoyl-4-chlorophenyl)-7-(difluoromethyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of CBKinase1_004334
Property Insights of CBKinase1_004334
The XLogP value of 4.50702 indicates that CBKinase1_004334 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.25 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004334. Following Lipinski's Rule of Five, CBKinase1_004334 has 1 hydrogen bond donor(s) and 5 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_004334?
The CAS number of CBKinase1_004334 is 664984-97-8.
What is the molecular formula of CBKinase1_004334?
The molecular formula of CBKinase1_004334 is C21H14ClF2N5O2.
What is the molecular weight of CBKinase1_004334?
The molecular weight of CBKinase1_004334 is 441.08 g/mol.
Where can I buy CBKinase1_004334?
You can request a quote for CBKinase1_004334 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004334?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004334 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.