(+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol
TL;DR: (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol (CAS 68779-67-9) is a chemical compound with molecular formula C17H20N2O and molecular weight 268.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(15R,17R,19S)-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18)-tetraen-17-ol
Also Known As: Vindeburnol, Vindeburnolum, Vindeburnol [INN], Vindeburnolum [Latin], (-)-Vindeburnol
| Molecular Formula | C17H20N2O |
|---|---|
| Molecular Weight | 268.16 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 28.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 268.15756 |
| Heavy Atoms | 20 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 68779-67-9 |
|---|---|
| SMILES | C1C[C@@H]2C[C@H](N3C4=CC=CC=C4C5=C3[C@H]2N(C1)CC5)O |
| InChIKey | KOIGYXJOGRVNIS-LYRGGWFBSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol (CAS 68779-67-9), with molecular formula C17H20N2O and molecular weight 268.16 g/mol. IUPAC: (15R,17R,19S)-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18)-tetraen-17-ol.
Chemical Property Profile of (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol
Property Insights of (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol. With a topological polar surface area (TPSA) of 28.4 Ų, (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol 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 (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol?
The CAS number of (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol is 68779-67-9.
What is the molecular formula of (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol?
The molecular formula of (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol is C17H20N2O.
What is the molecular weight of (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol?
The molecular weight of (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol is 268.16 g/mol.
Where can I buy (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol?
You can request a quote for (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol?
Yes, KEHONG BIO provides custom synthesis services for (+-)-(3alpha,14beta)-20,21-Dinoreburnamenin-14-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.