ChemDiv3_003066
TL;DR: ChemDiv3_003066 (CAS 383894-82-4) is a chemical compound with molecular formula C22H22N2O4 and molecular weight 378.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6,8-dimethylquinoline-3-carboxylate
Also Known As: ChemDiv3_003066, AF-399/40885756, BRD-K70326298-001-01-8, ethyl 4-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)amino)-6,8-dimethylquinoline-3-carboxylate, ethyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6,8-dimethyl-3-quinolinecarboxylate
| Molecular Formula | C22H22N2O4 |
|---|---|
| Molecular Weight | 378.16 g/mol |
| LogP | 4.54314 |
| Topological Polar Surface Area | 69.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 378.15796 |
| Heavy Atoms | 28 |
| Complexity | 1062.0764 |
Chemical Identifiers
| CAS Number | 383894-82-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=CC(=CC(=C2N=C1)C)C)NC3=CC4=C(C=C3)OCCO4 |
Product Overview
ChemDiv3_003066 (CAS 383894-82-4), with molecular formula C22H22N2O4 and molecular weight 378.16 g/mol. IUPAC: ethyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6,8-dimethylquinoline-3-carboxylate.
Chemical Property Profile of ChemDiv3_003066
Property Insights of ChemDiv3_003066
The XLogP value of 4.54314 indicates that ChemDiv3_003066 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.68 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_003066. Following Lipinski's Rule of Five, ChemDiv3_003066 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 ChemDiv3_003066?
The CAS number of ChemDiv3_003066 is 383894-82-4.
What is the molecular formula of ChemDiv3_003066?
The molecular formula of ChemDiv3_003066 is C22H22N2O4.
What is the molecular weight of ChemDiv3_003066?
The molecular weight of ChemDiv3_003066 is 378.16 g/mol.
Where can I buy ChemDiv3_003066?
You can request a quote for ChemDiv3_003066 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_003066?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_003066 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.