Ancistrocladine
TL;DR: Ancistrocladine (CAS 32221-59-3) is a chemical compound with molecular formula C25H29NO4 and molecular weight 407.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S)-5-(4,5-dimethoxy-2-methylnaphthalen-1-yl)-8-methoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-6-ol
Also Known As: Ancistrocladine, (1S)-5-(4,5-Dimethoxy-2-methyl-1-naphthyl)-8-methoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-6-ol, (1S)-5-(4,5-dimethoxy-2-methylnaphthalen-1-yl)-8-methoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-6-ol
| Molecular Formula | C25H29NO4 |
|---|---|
| Molecular Weight | 407.21 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 60.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.20966 |
| Heavy Atoms | 30 |
| Complexity | 573.0 |
Chemical Identifiers
| CAS Number | 32221-59-3 |
|---|---|
| SMILES | C[C@H]1C2=C(C=C(C(=C2CC(N1)C)C3=C4C=CC=C(C4=C(C=C3C)OC)OC)O)OC |
| InChIKey | XUFOYASAFNKRRE-LOACHALJSA-N |
Product Overview
Ancistrocladine (CAS 32221-59-3), with molecular formula C25H29NO4 and molecular weight 407.21 g/mol. IUPAC: (1S)-5-(4,5-dimethoxy-2-methylnaphthalen-1-yl)-8-methoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-6-ol.
Chemical Property Profile of Ancistrocladine
Property Insights of Ancistrocladine
The XLogP value of 5.0 indicates that Ancistrocladine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ancistrocladine. Following Lipinski's Rule of Five, Ancistrocladine has 2 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 Ancistrocladine?
The CAS number of Ancistrocladine is 32221-59-3.
What is the molecular formula of Ancistrocladine?
The molecular formula of Ancistrocladine is C25H29NO4.
What is the molecular weight of Ancistrocladine?
The molecular weight of Ancistrocladine is 407.21 g/mol.
Where can I buy Ancistrocladine?
You can request a quote for Ancistrocladine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ancistrocladine?
Yes, KEHONG BIO provides custom synthesis services for Ancistrocladine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.