N,O-Didemethylbuchenavianine
TL;DR: N,O-Didemethylbuchenavianine (CAS 91147-19-2) is a chemical compound with molecular formula C20H19NO4 and molecular weight 337.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dihydroxy-2-phenyl-8-piperidin-2-ylchromen-4-one
Also Known As: N,O-Didemethylbuchenavianine, N,O-Didemethyl-buchenavianine, 5,7-Dihydroxy-8-(2-piperidyl)flavone, J3.059.368E, 5,7-dihydroxy-2-phenyl-8-(piperidin-2-yl)-4H-chromen-4-one
| Molecular Formula | C20H19NO4 |
|---|---|
| Molecular Weight | 337.13 g/mol |
| LogP | 3.6858 |
| Topological Polar Surface Area | 82.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 337.1314 |
| Heavy Atoms | 25 |
| Complexity | 972.393 |
Chemical Identifiers
| CAS Number | 91147-19-2 |
|---|---|
| SMILES | C1CCNC(C1)C2=C(C=C(C3=C2OC(=CC3=O)C4=CC=CC=C4)O)O |
Product Overview
N,O-Didemethylbuchenavianine (CAS 91147-19-2), with molecular formula C20H19NO4 and molecular weight 337.13 g/mol. IUPAC: 5,7-dihydroxy-2-phenyl-8-piperidin-2-ylchromen-4-one.
Chemical Property Profile of N,O-Didemethylbuchenavianine
Property Insights of N,O-Didemethylbuchenavianine
The XLogP value of 3.6858 indicates that N,O-Didemethylbuchenavianine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N,O-Didemethylbuchenavianine. Following Lipinski's Rule of Five, N,O-Didemethylbuchenavianine has 3 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 N,O-Didemethylbuchenavianine?
The CAS number of N,O-Didemethylbuchenavianine is 91147-19-2.
What is the molecular formula of N,O-Didemethylbuchenavianine?
The molecular formula of N,O-Didemethylbuchenavianine is C20H19NO4.
What is the molecular weight of N,O-Didemethylbuchenavianine?
The molecular weight of N,O-Didemethylbuchenavianine is 337.13 g/mol.
Where can I buy N,O-Didemethylbuchenavianine?
You can request a quote for N,O-Didemethylbuchenavianine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,O-Didemethylbuchenavianine?
Yes, KEHONG BIO provides custom synthesis services for N,O-Didemethylbuchenavianine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.