CBKinase1_003669
TL;DR: CBKinase1_003669 (CAS 693828-46-5) is a chemical compound with molecular formula C18H19ClN2O5S and molecular weight 410.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-2-methylphenyl)-2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]acetamide
Also Known As: CBKinase1_003669, CBKinase1_016069, BRD-K33950790-001-01-4, N-(3-chloro-2-methylphenyl)-2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]acetamide, N-(3-chloro-2-methylphenyl)-N~2~-(2,3-dihydro-1,4-benzodioxin-6-yl)-N~2~-(methylsulfonyl)glycinamide
| Molecular Formula | C18H19ClN2O5S |
|---|---|
| Molecular Weight | 410.07 g/mol |
| LogP | 2.82432 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 410.0703 |
| Heavy Atoms | 27 |
| Complexity | 977.7124 |
Chemical Identifiers
| CAS Number | 693828-46-5 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)NC(=O)CN(C2=CC3=C(C=C2)OCCO3)S(=O)(=O)C |
Product Overview
CBKinase1_003669 (CAS 693828-46-5), with molecular formula C18H19ClN2O5S and molecular weight 410.07 g/mol. IUPAC: N-(3-chloro-2-methylphenyl)-2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]acetamide.
Chemical Property Profile of CBKinase1_003669
Property Insights of CBKinase1_003669
The XLogP value of 2.82432 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_003669. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_003669. Following Lipinski's Rule of Five, CBKinase1_003669 has 1 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_003669?
The CAS number of CBKinase1_003669 is 693828-46-5.
What is the molecular formula of CBKinase1_003669?
The molecular formula of CBKinase1_003669 is C18H19ClN2O5S.
What is the molecular weight of CBKinase1_003669?
The molecular weight of CBKinase1_003669 is 410.07 g/mol.
Where can I buy CBKinase1_003669?
You can request a quote for CBKinase1_003669 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_003669?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_003669 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.