Buphanamine
TL;DR: Buphanamine (CAS 78734-78-8) is a chemical compound with molecular formula C17H19NO4 and molecular weight 301.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,13R,17R)-9-methoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9,15-tetraen-17-ol
Also Known As: Buphanamine, Buphanamin, Buphanamine [MI], BUPHANAMINE, 2-, BUPHANAMIN B678018K240
| Molecular Formula | C17H19NO4 |
|---|---|
| Molecular Weight | 301.13 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 301.1314 |
| Heavy Atoms | 22 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 78734-78-8 |
|---|---|
| SMILES | COC1=C2CN3CC[C@@]4([C@H]3CC=C[C@H]4O)C2=CC5=C1OCO5 |
| InChIKey | XJJVWAWKCIATTE-CPUCHLNUSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Buphanamine (CAS 78734-78-8), with molecular formula C17H19NO4 and molecular weight 301.13 g/mol. IUPAC: (1S,13R,17R)-9-methoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9,15-tetraen-17-ol.
Chemical Property Profile of Buphanamine
Property Insights of Buphanamine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Buphanamine. With a topological polar surface area (TPSA) of 51.2 Ų, Buphanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Buphanamine has 1 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 Buphanamine?
The CAS number of Buphanamine is 78734-78-8.
What is the molecular formula of Buphanamine?
The molecular formula of Buphanamine is C17H19NO4.
What is the molecular weight of Buphanamine?
The molecular weight of Buphanamine is 301.13 g/mol.
Where can I buy Buphanamine?
You can request a quote for Buphanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Buphanamine?
Yes, KEHONG BIO provides custom synthesis services for Buphanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.