9H-Voacangine, 9-hydroxy-
TL;DR: 9H-Voacangine, 9-hydroxy- (CAS 3464-63-9) is a chemical compound with molecular formula C22H28N2O4 and molecular weight 384.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (15S,17R)-17-ethyl-10-hydroxy-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2,4(9),5,7-tetraene-1-carboxylate
Also Known As: 9H-Voacangine, 9-hydroxy-, Voacangine hydroxyindolenine, 9H-Voacangine,9-hydroxy, 7-Hydroxy-1-dehydrovoacangine, 7alpha-Voacangine hydroxyindolenine
| Molecular Formula | C22H28N2O4 |
|---|---|
| Molecular Weight | 384.20 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.2049 |
| Heavy Atoms | 28 |
| Complexity | 696.0 |
Chemical Identifiers
| CAS Number | 3464-63-9 |
|---|---|
| SMILES | CC[C@@H]1C[C@H]2CC3(C1N(C2)CCC4(C3=NC5=C4C=C(C=C5)OC)O)C(=O)OC |
| InChIKey | AVRFPRAAVSCSSZ-GSEWTJHMSA-N |
Product Overview
9H-Voacangine, 9-hydroxy- (CAS 3464-63-9), with molecular formula C22H28N2O4 and molecular weight 384.20 g/mol. IUPAC: methyl (15S,17R)-17-ethyl-10-hydroxy-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2,4(9),5,7-tetraene-1-carboxylate.
Chemical Property Profile of 9H-Voacangine, 9-hydroxy-
Property Insights of 9H-Voacangine, 9-hydroxy-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9H-Voacangine, 9-hydroxy-. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 9H-Voacangine, 9-hydroxy-. Following Lipinski's Rule of Five, 9H-Voacangine, 9-hydroxy- 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 9H-Voacangine, 9-hydroxy-?
The CAS number of 9H-Voacangine, 9-hydroxy- is 3464-63-9.
What is the molecular formula of 9H-Voacangine, 9-hydroxy-?
The molecular formula of 9H-Voacangine, 9-hydroxy- is C22H28N2O4.
What is the molecular weight of 9H-Voacangine, 9-hydroxy-?
The molecular weight of 9H-Voacangine, 9-hydroxy- is 384.20 g/mol.
Where can I buy 9H-Voacangine, 9-hydroxy-?
You can request a quote for 9H-Voacangine, 9-hydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9H-Voacangine, 9-hydroxy-?
Yes, KEHONG BIO provides custom synthesis services for 9H-Voacangine, 9-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.