3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide
TL;DR: 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide (CAS 17224-49-6) is a chemical compound with molecular formula C24H41NO4 and molecular weight 407.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3S,5S,8R,9S,10S,13S,14S)-3-acetyloxy-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-2-yl]-trimethylazanium hydroxide
Also Known As: (3-alpha-Hydroxy-17-oxo-5-alpha-androstan-2-beta-yl)trimethylammonium hydroxide acetate, 3-alpha-Acetoxy-2-beta-dimethylamino-5-alpha-androstan-17-one methohydroxide, 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide, Ammonium, (3-alpha-hydroxy-17-oxo-5-alpha-androstan-2-beta-yl)trimethyl-, hydroxide, acetate, 3alpha-(Acetyloxy)-N,N,N-trimethyl-17-oxo-5alpha-androstan-2beta-aminium hydroxide
| Molecular Formula | C24H41NO4 |
|---|---|
| Molecular Weight | 407.30 g/mol |
| LogP | 4.0378 |
| Topological Polar Surface Area | 44.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 407.30356 |
| Heavy Atoms | 29 |
| Complexity | 667.0 |
Chemical Identifiers
| CAS Number | 17224-49-6 |
|---|---|
| SMILES | CC(=O)O[C@H]1C[C@@H]2CC[C@H]3[C@@H]4CCC(=O)[C@]4(CC[C@@H]3[C@]2(C[C@@H]1[N+](C)(C)C)C)C.[OH-] |
| InChIKey | KIBPXWVAJWZCGC-NAPZGIGWSA-M |
Product Overview
3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide (CAS 17224-49-6), with molecular formula C24H41NO4 and molecular weight 407.30 g/mol. IUPAC: [(2S,3S,5S,8R,9S,10S,13S,14S)-3-acetyloxy-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-2-yl]-trimethylazanium hydroxide.
Chemical Property Profile of 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide
Property Insights of 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide
The XLogP value of 4.0378 indicates that 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.4 Ų, 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide has 1 hydrogen bond donor(s) and 4 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-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide?
The CAS number of 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide is 17224-49-6.
What is the molecular formula of 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide?
The molecular formula of 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide is C24H41NO4.
What is the molecular weight of 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide?
The molecular weight of 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide is 407.30 g/mol.
Where can I buy 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide?
You can request a quote for 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide?
Yes, KEHONG BIO provides custom synthesis services for 3-(Acetyloxy)-N,N,N-trimethyl-17-oxoandrostan-2-aminium hydroxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.