CBKinase1_004906
TL;DR: CBKinase1_004906 (CAS 662159-24-2) is a chemical compound with molecular formula C19H17N5O3S and molecular weight 395.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(3,4-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-(1-oxo-3H-2-benzofuran-5-yl)acetamide
Also Known As: CBKinase1_004906, CBKinase1_017306, AN-465/42154500, 2-[1-(3,4-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-(1-oxo-3H-2-benzofuran-5-yl)acetamide, BRD-K31339066-001-01-9
| Molecular Formula | C19H17N5O3S |
|---|---|
| Molecular Weight | 395.11 g/mol |
| LogP | 2.68034 |
| Topological Polar Surface Area | 99.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.10522 |
| Heavy Atoms | 28 |
| Complexity | 1079.1812 |
Chemical Identifiers
| CAS Number | 662159-24-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=CC4=C(C=C3)C(=O)OC4)C |
Product Overview
CBKinase1_004906 (CAS 662159-24-2), with molecular formula C19H17N5O3S and molecular weight 395.11 g/mol. IUPAC: 2-[1-(3,4-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-(1-oxo-3H-2-benzofuran-5-yl)acetamide.
Chemical Property Profile of CBKinase1_004906
Property Insights of CBKinase1_004906
The XLogP value of 2.68034 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_004906. The TPSA of 99.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004906. Following Lipinski's Rule of Five, CBKinase1_004906 has 1 hydrogen bond donor(s) and 7 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_004906?
The CAS number of CBKinase1_004906 is 662159-24-2.
What is the molecular formula of CBKinase1_004906?
The molecular formula of CBKinase1_004906 is C19H17N5O3S.
What is the molecular weight of CBKinase1_004906?
The molecular weight of CBKinase1_004906 is 395.11 g/mol.
Where can I buy CBKinase1_004906?
You can request a quote for CBKinase1_004906 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004906?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004906 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.