RU 54115
TL;DR: RU 54115 (CAS 137437-16-2) is a chemical compound with molecular formula C21H28O2S and molecular weight 344.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,13S,14S)-13-methyl-10-(2-methylsulfanylethyl)-2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-3,17-dione
Also Known As: RU 54115, 10-methylthioethylestra-4,9 -diene3,17-dione, (8S,13S,14S)-13-methyl-10-(2-methylsulfanylethyl)-2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-3,17-dione
| Molecular Formula | C21H28O2S |
|---|---|
| Molecular Weight | 344.18 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 59.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.181 |
| Heavy Atoms | 24 |
| Complexity | 646.0 |
Chemical Identifiers
| CAS Number | 137437-16-2 |
|---|---|
| SMILES | C[C@]12CC=C3[C@H]([C@@H]1CCC2=O)CCC4=CC(=O)CCC43CCSC |
| InChIKey | JKOMPAPOBLVXKS-SLTGRBBCSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RU 54115 (CAS 137437-16-2), with molecular formula C21H28O2S and molecular weight 344.18 g/mol. IUPAC: (8S,13S,14S)-13-methyl-10-(2-methylsulfanylethyl)-2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-3,17-dione.
Chemical Property Profile of RU 54115
Property Insights of RU 54115
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RU 54115. With a topological polar surface area (TPSA) of 59.4 Ų, RU 54115 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RU 54115 has 0 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 RU 54115?
The CAS number of RU 54115 is 137437-16-2.
What is the molecular formula of RU 54115?
The molecular formula of RU 54115 is C21H28O2S.
What is the molecular weight of RU 54115?
The molecular weight of RU 54115 is 344.18 g/mol.
Where can I buy RU 54115?
You can request a quote for RU 54115 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RU 54115?
Yes, KEHONG BIO provides custom synthesis services for RU 54115 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.