19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate
TL;DR: 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate (CAS 101832-66-0) is a chemical compound with molecular formula C22H34O3 and molecular weight 346.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,8R,9S,10R,13S,14S)-17-ethyl-17-hydroxy-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
Also Known As: 17-Hydroxy-19-norpregn-4-en-3-yl acetate, 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate, (17xi)-17-Hydroxy-19-norpregn-4-en-3beta-yl acetate, [(3S,8R,9S,10R,13S,14S)-17-ethyl-17-hydroxy-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
| Molecular Formula | C22H34O3 |
|---|---|
| Molecular Weight | 346.25 g/mol |
| LogP | 4.6319 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 346.2508 |
| Heavy Atoms | 25 |
| Complexity | 581.8214 |
Chemical Identifiers
| CAS Number | 101832-66-0 |
|---|---|
| SMILES | CCC1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=C[C@H](CC[C@H]34)OC(=O)C)C)O |
Product Overview
19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate (CAS 101832-66-0), with molecular formula C22H34O3 and molecular weight 346.25 g/mol. IUPAC: [(3S,8R,9S,10R,13S,14S)-17-ethyl-17-hydroxy-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate.
Chemical Property Profile of 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate
Property Insights of 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate
The XLogP value of 4.6319 indicates that 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate 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 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate?
The CAS number of 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate is 101832-66-0.
What is the molecular formula of 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate?
The molecular formula of 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate is C22H34O3.
What is the molecular weight of 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate?
The molecular weight of 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate is 346.25 g/mol.
Where can I buy 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate?
You can request a quote for 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate?
Yes, KEHONG BIO provides custom synthesis services for 19-Nor-17-alpha-pregn-4-ene-3,17-beta-diol, 3-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.