CBKinase1_005508
TL;DR: CBKinase1_005508 (CAS 701225-97-0) is a chemical compound with molecular formula C19H19N5O2S and molecular weight 381.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-acetylphenyl)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: CBKinase1_005508, CBKinase1_017908, BAS 09627899, BRD-K33194479-001-01-7, N-(3-acetylphenyl)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
| Molecular Formula | C19H19N5O2S |
|---|---|
| Molecular Weight | 381.13 g/mol |
| LogP | 3.2934 |
| Topological Polar Surface Area | 89.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 381.12595 |
| Heavy Atoms | 27 |
| Complexity | 955.74365 |
Chemical Identifiers
| CAS Number | 701225-97-0 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)C)C3=CC=NC=C3 |
Product Overview
CBKinase1_005508 (CAS 701225-97-0), with molecular formula C19H19N5O2S and molecular weight 381.13 g/mol. IUPAC: N-(3-acetylphenyl)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_005508
Property Insights of CBKinase1_005508
The XLogP value of 3.2934 indicates that CBKinase1_005508 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.77 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_005508. Following Lipinski's Rule of Five, CBKinase1_005508 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_005508?
The CAS number of CBKinase1_005508 is 701225-97-0.
What is the molecular formula of CBKinase1_005508?
The molecular formula of CBKinase1_005508 is C19H19N5O2S.
What is the molecular weight of CBKinase1_005508?
The molecular weight of CBKinase1_005508 is 381.13 g/mol.
Where can I buy CBKinase1_005508?
You can request a quote for CBKinase1_005508 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_005508?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_005508 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.