CBKinase1_007546
TL;DR: CBKinase1_007546 (CAS 637325-75-8) is a chemical compound with molecular formula C16H17N5O2S and molecular weight 343.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-methyl-5-[(2-methylquinolin-8-yl)oxymethyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: CBKinase1_007546, CBKinase1_019946, BRD-K78279812-001-01-8, 2-[[4-methyl-5-[(2-methylquinolin-8-yl)oxymethyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide, 2-{4-methyl-5-[(2-methyl(8-quinolyloxy))methyl]-1,2,4-triazol-3-ylthio}acetami de
| Molecular Formula | C16H17N5O2S |
|---|---|
| Molecular Weight | 343.11 g/mol |
| LogP | 1.82812 |
| Topological Polar Surface Area | 95.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 343.1103 |
| Heavy Atoms | 24 |
| Complexity | 893.3052 |
Chemical Identifiers
| CAS Number | 637325-75-8 |
|---|---|
| SMILES | CC1=NC2=C(C=CC=C2OCC3=NN=C(N3C)SCC(=O)N)C=C1 |
Product Overview
CBKinase1_007546 (CAS 637325-75-8), with molecular formula C16H17N5O2S and molecular weight 343.11 g/mol. IUPAC: 2-[[4-methyl-5-[(2-methylquinolin-8-yl)oxymethyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_007546
Property Insights of CBKinase1_007546
The XLogP value of 1.82812 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_007546. The TPSA of 95.92 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_007546. Following Lipinski's Rule of Five, CBKinase1_007546 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_007546?
The CAS number of CBKinase1_007546 is 637325-75-8.
What is the molecular formula of CBKinase1_007546?
The molecular formula of CBKinase1_007546 is C16H17N5O2S.
What is the molecular weight of CBKinase1_007546?
The molecular weight of CBKinase1_007546 is 343.11 g/mol.
Where can I buy CBKinase1_007546?
You can request a quote for CBKinase1_007546 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007546?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007546 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.