3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione
TL;DR: 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione (CAS 55675-00-8) is a chemical compound with molecular formula C19H22O3 and molecular weight 298.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S,13S,14S)-3-hydroxy-1,13-dimethyl-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthrene-11,17-dione
Also Known As: HMETD, 1-Methyl-11-oxoestrone, 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione, 3-hydroxy-1-methyl-1,3,5 -estratriene-11,17-dione, Estra-1,3,5(10)-triene-11,17-dione, 3-hydroxy-1-methyl-
| Molecular Formula | C19H22O3 |
|---|---|
| Molecular Weight | 298.16 g/mol |
| LogP | 3.30482 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 298.1569 |
| Heavy Atoms | 22 |
| Complexity | 690.1659 |
Chemical Identifiers
| CAS Number | 55675-00-8 |
|---|---|
| SMILES | CC1=CC(=CC2=C1[C@@H]3[C@@H](CC2)[C@@H]4CCC(=O)[C@]4(CC3=O)C)O |
Product Overview
3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione (CAS 55675-00-8), with molecular formula C19H22O3 and molecular weight 298.16 g/mol. IUPAC: (8S,9S,13S,14S)-3-hydroxy-1,13-dimethyl-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthrene-11,17-dione.
Chemical Property Profile of 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione
Property Insights of 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione
The XLogP value of 3.30482 indicates that 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.37 Ų, 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione has 1 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 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione?
The CAS number of 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione is 55675-00-8.
What is the molecular formula of 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione?
The molecular formula of 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione is C19H22O3.
What is the molecular weight of 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione?
The molecular weight of 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione is 298.16 g/mol.
Where can I buy 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione?
You can request a quote for 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-1-methyl-1,3,5(10)-estratriene-11,17-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.