![(16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate structure](/static/products/6351/63518-06-9.webp)
(16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate
TL;DR: (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate (CAS 63518-06-9) is a chemical compound with molecular formula C26H37NO3 and molecular weight 411.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(16E)-10,13-dimethyl-17-oxo-16-(pyrrolidin-1-ylmethylidene)-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
Also Known As: (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate, [(16E)-10,13-dimethyl-17-oxo-16-(pyrrolidin-1-ylmethylidene)-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
| Molecular Formula | C26H37NO3 |
|---|---|
| Molecular Weight | 411.28 g/mol |
| LogP | 5.0396 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 411.27734 |
| Heavy Atoms | 30 |
| Complexity | 807.0964 |
Chemical Identifiers
| CAS Number | 63518-06-9 |
|---|---|
| SMILES | CC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)C/C(=C\N5CCCC5)/C4=O)C)C |
Product Overview
(16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate (CAS 63518-06-9), with molecular formula C26H37NO3 and molecular weight 411.28 g/mol. IUPAC: [(16E)-10,13-dimethyl-17-oxo-16-(pyrrolidin-1-ylmethylidene)-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate.
Chemical Property Profile of (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate
Property Insights of (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate
The XLogP value of 5.0396 indicates that (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate?
The CAS number of (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate is 63518-06-9.
What is the molecular formula of (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate?
The molecular formula of (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate is C26H37NO3.
What is the molecular weight of (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate?
The molecular weight of (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate is 411.28 g/mol.
Where can I buy (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate?
You can request a quote for (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for (16E)-17-Oxo-16-[(pyrrolidin-1-yl)methylidene]androst-5-en-3-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.