Choisyine
TL;DR: Choisyine (CAS 18671-54-0) is a chemical compound with molecular formula C18H19NO5 and molecular weight 329.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(7,16-dimethoxy-5,12-dioxa-10-azatetracyclo[7.7.0.02,6.011,15]hexadeca-1,6,8,10,13,15-hexaen-4-yl)propan-2-ol
Also Known As: Choisyine, 1,2-epoxy-10-chlorodecane, 2-(4,10-dimethoxy-1,2-dihydrodifuro[2,3-b:3',2'-f]quinolin-2-yl)propan-2-ol, 2-(4,10-dimethoxy-1,2-dihydrodifuro[2,3-b:3',2'-f]quinolin-2, 1,2-Dihydro-4,10-dimethoxy-alpha,alpha-dimethyldifuro[2,3-b:3 ,2 -f]quinoline-2-methanol
| Molecular Formula | C18H19NO5 |
|---|---|
| Molecular Weight | 329.13 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 74.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.1263 |
| Heavy Atoms | 24 |
| Complexity | 472.0 |
Chemical Identifiers
| CAS Number | 18671-54-0 |
|---|---|
| SMILES | CC(C)(C1CC2=C3C(=CC(=C2O1)OC)N=C4C(=C3OC)C=CO4)O |
| InChIKey | OCKCNDIOPSOBNM-UHFFFAOYSA-N |
Product Overview
Choisyine (CAS 18671-54-0), with molecular formula C18H19NO5 and molecular weight 329.13 g/mol. IUPAC: 2-(7,16-dimethoxy-5,12-dioxa-10-azatetracyclo[7.7.0.02,6.011,15]hexadeca-1,6,8,10,13,15-hexaen-4-yl)propan-2-ol.
Chemical Property Profile of Choisyine
Property Insights of Choisyine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Choisyine. The TPSA of 74.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Choisyine. Following Lipinski's Rule of Five, Choisyine 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 Choisyine?
The CAS number of Choisyine is 18671-54-0.
What is the molecular formula of Choisyine?
The molecular formula of Choisyine is C18H19NO5.
What is the molecular weight of Choisyine?
The molecular weight of Choisyine is 329.13 g/mol.
Where can I buy Choisyine?
You can request a quote for Choisyine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Choisyine?
Yes, KEHONG BIO provides custom synthesis services for Choisyine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.