CBKinase1_005398
TL;DR: CBKinase1_005398 (CAS 579439-87-5) is a chemical compound with molecular formula C19H15N5OS and molecular weight 361.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-naphthalen-1-yl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: CBKinase1_005398, CBKinase1_017798, BAS 06997277, BRD-K03082518-001-01-3, N-(naphthalen-1-yl)-2-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C19H15N5OS |
|---|---|
| Molecular Weight | 361.10 g/mol |
| LogP | 3.7507 |
| Topological Polar Surface Area | 83.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 361.09973 |
| Heavy Atoms | 26 |
| Complexity | 1042.6902 |
Chemical Identifiers
| CAS Number | 579439-87-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2NC(=O)CSC3=NNC(=N3)C4=CC=NC=C4 |
Product Overview
CBKinase1_005398 (CAS 579439-87-5), with molecular formula C19H15N5OS and molecular weight 361.10 g/mol. IUPAC: N-naphthalen-1-yl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_005398
Property Insights of CBKinase1_005398
The XLogP value of 3.7507 indicates that CBKinase1_005398 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.56 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_005398. Following Lipinski's Rule of Five, CBKinase1_005398 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_005398?
The CAS number of CBKinase1_005398 is 579439-87-5.
What is the molecular formula of CBKinase1_005398?
The molecular formula of CBKinase1_005398 is C19H15N5OS.
What is the molecular weight of CBKinase1_005398?
The molecular weight of CBKinase1_005398 is 361.10 g/mol.
Where can I buy CBKinase1_005398?
You can request a quote for CBKinase1_005398 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_005398?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_005398 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.