CBKinase1_007938
TL;DR: CBKinase1_007938 (CAS 1093070-93-9) is a chemical compound with molecular formula C12H9ClFN5O2 and molecular weight 309.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-fluorophenyl)-7-oxo-5,6-dihydro-4H-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide
Also Known As: CBKinase1_007938, CBKinase1_020338, BAS 08978545, AJ-292/42806433, N-(3-chloro-4-fluorophenyl)-7-oxo-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide
| Molecular Formula | C12H9ClFN5O2 |
|---|---|
| Molecular Weight | 309.04 g/mol |
| LogP | 1.5337 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 309.04288 |
| Heavy Atoms | 21 |
| Complexity | 732.1879 |
Chemical Identifiers
| CAS Number | 1093070-93-9 |
|---|---|
| SMILES | C1C(NC2=NC=NN2C1=O)C(=O)NC3=CC(=C(C=C3)F)Cl |
Product Overview
CBKinase1_007938 (CAS 1093070-93-9), with molecular formula C12H9ClFN5O2 and molecular weight 309.04 g/mol. IUPAC: N-(3-chloro-4-fluorophenyl)-7-oxo-5,6-dihydro-4H-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide.
Chemical Property Profile of CBKinase1_007938
Property Insights of CBKinase1_007938
The XLogP value of 1.5337 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_007938. The TPSA of 88.91 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_007938. Following Lipinski's Rule of Five, CBKinase1_007938 has 2 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_007938?
The CAS number of CBKinase1_007938 is 1093070-93-9.
What is the molecular formula of CBKinase1_007938?
The molecular formula of CBKinase1_007938 is C12H9ClFN5O2.
What is the molecular weight of CBKinase1_007938?
The molecular weight of CBKinase1_007938 is 309.04 g/mol.
Where can I buy CBKinase1_007938?
You can request a quote for CBKinase1_007938 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007938?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007938 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.