CBKinase1_007127
TL;DR: CBKinase1_007127 (CAS 483327-10-2) is a chemical compound with molecular formula C16H14FN5OS and molecular weight 343.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-fluorophenyl)-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: CBKinase1_007127, CBKinase1_019527, N-(4-fluorophenyl)-2-{[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, BRD-K53686777-001-01-6, A3365/0142895
| Molecular Formula | C16H14FN5OS |
|---|---|
| Molecular Weight | 343.09 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.0903 |
| Heavy Atoms | 24 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 483327-10-2 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)F)C3=CN=CC=C3 |
| InChIKey | OPPWUDGACCNQJI-UHFFFAOYSA-N |
Product Overview
CBKinase1_007127 (CAS 483327-10-2), with molecular formula C16H14FN5OS and molecular weight 343.09 g/mol. IUPAC: N-(4-fluorophenyl)-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_007127
Property Insights of CBKinase1_007127
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_007127. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_007127. Following Lipinski's Rule of Five, CBKinase1_007127 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_007127?
The CAS number of CBKinase1_007127 is 483327-10-2.
What is the molecular formula of CBKinase1_007127?
The molecular formula of CBKinase1_007127 is C16H14FN5OS.
What is the molecular weight of CBKinase1_007127?
The molecular weight of CBKinase1_007127 is 343.09 g/mol.
Where can I buy CBKinase1_007127?
You can request a quote for CBKinase1_007127 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007127?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007127 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.