柯楝桔碱
TL;DR: 柯楝桔碱 (CAS 21087-98-9) is a chemical compound with molecular formula C19H19NO2 and molecular weight 293.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
柯楝桔碱
8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazole
Also Known As: Koenimbine, Kenimbine, Koenimbin, Koenimbine?, 8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazole
| Molecular Formula | C19H19NO2 |
|---|---|
| Molecular Weight | 293.14 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 34.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 293.14157 |
| Heavy Atoms | 22 |
| Complexity | 460.0 |
| Melting Point | 194 - 195 °C |
Chemical Identifiers
| CAS Number | 21087-98-9 |
|---|---|
| SMILES | CC1=CC2=C(C3=C1OC(C=C3)(C)C)NC4=C2C=C(C=C4)OC |
| InChIKey | OSERHKINMDLESD-UHFFFAOYSA-N |
Product Overview
柯楝桔碱 (CAS 21087-98-9), with molecular formula C19H19NO2 and molecular weight 293.14 g/mol. IUPAC: 8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazole.
Chemical Property Profile of 柯楝桔碱
Property Insights of 柯楝桔碱
The XLogP value of 4.6 indicates that 柯楝桔碱 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.3 Ų, 柯楝桔碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 柯楝桔碱 has 1 hydrogen bond donor(s) and 2 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 柯楝桔碱?
The CAS number of 柯楝桔碱 is 21087-98-9.
What is the molecular formula of 柯楝桔碱?
The molecular formula of 柯楝桔碱 is C19H19NO2.
What is the molecular weight of 柯楝桔碱?
The molecular weight of 柯楝桔碱 is 293.14 g/mol.
Where can I buy 柯楝桔碱?
You can request a quote for 柯楝桔碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 柯楝桔碱?
Yes, KEHONG BIO provides custom synthesis services for 柯楝桔碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.