CBKinase1_008381
TL;DR: CBKinase1_008381 (CAS 444161-70-0) is a chemical compound with molecular formula C20H20ClN3OS and molecular weight 385.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-2-[(3-cyano-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-2-yl)sulfanyl]acetamide
Also Known As: CBKinase1_008381, CBKinase1_020781, N-(4-chlorophenyl)-2-[(3-cyano-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-2-yl)sulfanyl]acetamide, AM-807/14146465, BRD-K16482882-001-01-8
| Molecular Formula | C20H20ClN3OS |
|---|---|
| Molecular Weight | 385.10 g/mol |
| LogP | 4.99648 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 385.10156 |
| Heavy Atoms | 26 |
| Complexity | 830.1853 |
Chemical Identifiers
| CAS Number | 444161-70-0 |
|---|---|
| SMILES | C1CCCC2=NC(=C(C=C2CC1)C#N)SCC(=O)NC3=CC=C(C=C3)Cl |
Product Overview
CBKinase1_008381 (CAS 444161-70-0), with molecular formula C20H20ClN3OS and molecular weight 385.10 g/mol. IUPAC: N-(4-chlorophenyl)-2-[(3-cyano-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_008381
Property Insights of CBKinase1_008381
The XLogP value of 4.99648 indicates that CBKinase1_008381 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_008381. Following Lipinski's Rule of Five, CBKinase1_008381 has 1 hydrogen bond donor(s) and 4 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_008381?
The CAS number of CBKinase1_008381 is 444161-70-0.
What is the molecular formula of CBKinase1_008381?
The molecular formula of CBKinase1_008381 is C20H20ClN3OS.
What is the molecular weight of CBKinase1_008381?
The molecular weight of CBKinase1_008381 is 385.10 g/mol.
Where can I buy CBKinase1_008381?
You can request a quote for CBKinase1_008381 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_008381?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_008381 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.