(-)-Dicentrine
TL;DR: (-)-Dicentrine (CAS 28832-07-7) is a chemical compound with molecular formula C20H21NO4 and molecular weight 339.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(12R)-16,17-dimethoxy-11-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14,16,18-hexaene
Also Known As: (-)-Dicentrine, L-DICENTRINE, Dicentrine, (-)-, Dicentrine, (R)-(-)-Dicentrine
| Molecular Formula | C20H21NO4 |
|---|---|
| Molecular Weight | 339.15 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 40.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 339.14706 |
| Heavy Atoms | 25 |
| Complexity | 502.0 |
Chemical Identifiers
| CAS Number | 28832-07-7 |
|---|---|
| SMILES | CN1CCC2=CC3=C(C4=C2[C@H]1CC5=CC(=C(C=C54)OC)OC)OCO3 |
| InChIKey | YJWBWQWUHVXPNC-CQSZACIVSA-N |
Product Overview
(-)-Dicentrine (CAS 28832-07-7), with molecular formula C20H21NO4 and molecular weight 339.15 g/mol. IUPAC: (12R)-16,17-dimethoxy-11-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14,16,18-hexaene.
Chemical Property Profile of (-)-Dicentrine
Property Insights of (-)-Dicentrine
The XLogP value of 3.2 indicates that (-)-Dicentrine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.2 Ų, (-)-Dicentrine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (-)-Dicentrine has 0 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 (-)-Dicentrine?
The CAS number of (-)-Dicentrine is 28832-07-7.
What is the molecular formula of (-)-Dicentrine?
The molecular formula of (-)-Dicentrine is C20H21NO4.
What is the molecular weight of (-)-Dicentrine?
The molecular weight of (-)-Dicentrine is 339.15 g/mol.
Where can I buy (-)-Dicentrine?
You can request a quote for (-)-Dicentrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (-)-Dicentrine?
Yes, KEHONG BIO provides custom synthesis services for (-)-Dicentrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.