CBKinase1_007385
TL;DR: CBKinase1_007385 (CAS 708285-79-4) is a chemical compound with molecular formula C18H18ClN5O3S and molecular weight 419.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-2,4-dimethoxyphenyl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: CBKinase1_007385, CBKinase1_019785, BRD-K74994599-001-01-5, N-(5-chloro-2,4-dimethoxyphenyl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-(5-chloro-2,4-dimethoxyphenyl)-2-{[4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C18H18ClN5O3S |
|---|---|
| Molecular Weight | 419.08 g/mol |
| LogP | 3.2785 |
| Topological Polar Surface Area | 91.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 419.08188 |
| Heavy Atoms | 28 |
| Complexity | 980.8525 |
Chemical Identifiers
| CAS Number | 708285-79-4 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2OC)OC)Cl)C3=CC=NC=C3 |
Product Overview
CBKinase1_007385 (CAS 708285-79-4), with molecular formula C18H18ClN5O3S and molecular weight 419.08 g/mol. IUPAC: N-(5-chloro-2,4-dimethoxyphenyl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_007385
Property Insights of CBKinase1_007385
The XLogP value of 3.2785 indicates that CBKinase1_007385 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.16 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_007385. Following Lipinski's Rule of Five, CBKinase1_007385 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_007385?
The CAS number of CBKinase1_007385 is 708285-79-4.
What is the molecular formula of CBKinase1_007385?
The molecular formula of CBKinase1_007385 is C18H18ClN5O3S.
What is the molecular weight of CBKinase1_007385?
The molecular weight of CBKinase1_007385 is 419.08 g/mol.
Where can I buy CBKinase1_007385?
You can request a quote for CBKinase1_007385 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007385?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007385 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.