Ancistrocongoline C
TL;DR: Ancistrocongoline C (CAS 455255-19-3) is a chemical compound with molecular formula C26H31NO4 and molecular weight 421.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,3R)-5-(4,5-dimethoxy-7-methylnaphthalen-1-yl)-8-methoxy-1,2,3-trimethyl-3,4-dihydro-1H-isoquinolin-6-ol
Also Known As: Ancistrocongoline C, J1.792.867H, (1R,3R)-5-(4,5-dimethoxy-7-methylnaphthalen-1-yl)-8-methoxy-1,2,3-trimethyl-3,4-dihydro-1H-isoquinolin-6-ol, 6-Isoquinolinol, 5-(4,5-dimethoxy-7-methyl-1-naphthalenyl)-1,2,3,4-tetrahydro-8-methoxy-1,2,3-trimethyl-, (1R,3R,5R)-, (1R)-1,2,3,4-Tetrahydro-8-methoxy-1beta,2,3alpha-trimethyl-5-(4,5-dimethoxy-7-methyl-1-naphthyl)isoquinoline-6-ol
| Molecular Formula | C26H31NO4 |
|---|---|
| Molecular Weight | 421.23 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 421.2253 |
| Heavy Atoms | 31 |
| Complexity | 602.0 |
Chemical Identifiers
| CAS Number | 455255-19-3 |
|---|---|
| SMILES | C[C@@H]1CC2=C(C(=CC(=C2[C@H](N1C)C)OC)O)C3=C4C=C(C=C(C4=C(C=C3)OC)OC)C |
| InChIKey | RNLKCMIGQLHEKX-HZPDHXFCSA-N |
Product Overview
Ancistrocongoline C (CAS 455255-19-3), with molecular formula C26H31NO4 and molecular weight 421.23 g/mol. IUPAC: (1R,3R)-5-(4,5-dimethoxy-7-methylnaphthalen-1-yl)-8-methoxy-1,2,3-trimethyl-3,4-dihydro-1H-isoquinolin-6-ol.
Chemical Property Profile of Ancistrocongoline C
Property Insights of Ancistrocongoline C
The XLogP value of 5.4 indicates that Ancistrocongoline C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, Ancistrocongoline C exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ancistrocongoline C has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ancistrocongoline C?
The CAS number of Ancistrocongoline C is 455255-19-3.
What is the molecular formula of Ancistrocongoline C?
The molecular formula of Ancistrocongoline C is C26H31NO4.
What is the molecular weight of Ancistrocongoline C?
The molecular weight of Ancistrocongoline C is 421.23 g/mol.
Where can I buy Ancistrocongoline C?
You can request a quote for Ancistrocongoline C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ancistrocongoline C?
Yes, KEHONG BIO provides custom synthesis services for Ancistrocongoline C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.