RU-16117
TL;DR: RU-16117 (CAS 61665-15-4) is a chemical compound with molecular formula C21H26O3 and molecular weight 326.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
RU-16117
(8S,9S,11R,13S,14S,17R)-17-ethynyl-11-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
Also Known As: Moxestrol, 11alpha-Methoxyethinylestradiol, 11-alpha-Methoxyethinylestradiol, RU 16117, NIOSH/RC8944500
| Molecular Formula | C21H26O3 |
|---|---|
| Molecular Weight | 326.19 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.1882 |
| Heavy Atoms | 24 |
| Complexity | 551.0 |
Chemical Identifiers
| CAS Number | 61665-15-4 |
|---|---|
| SMILES | C[C@]12C[C@H]([C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O)OC |
| InChIKey | MTMZZIPTQITGCY-QHOCJJNXSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RU-16117 (CAS 61665-15-4), with molecular formula C21H26O3 and molecular weight 326.19 g/mol. IUPAC: (8S,9S,11R,13S,14S,17R)-17-ethynyl-11-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol.
Chemical Property Profile of RU-16117
Property Insights of RU-16117
The XLogP value of 3.0 indicates that Chemical Compound (C21H26O3) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, RU-16117 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chemical Compound (C21H26O3) has 2 hydrogen bond donor(s) and 3 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 Chemical Compound (C21H26O3)?
The CAS number of Chemical Compound (C21H26O3) is 61665-15-4.
What is the molecular formula of Chemical Compound (C21H26O3)?
The molecular formula of Chemical Compound (C21H26O3) is C21H26O3.
What is the molecular weight of Chemical Compound (C21H26O3)?
The molecular weight of Chemical Compound (C21H26O3) is 326.19 g/mol.
Where can I buy Chemical Compound (C21H26O3)?
You can request a quote for Chemical Compound (C21H26O3) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chemical Compound (C21H26O3)?
Yes, KEHONG BIO provides custom synthesis services for Chemical Compound (C21H26O3) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.