3beta-Hydroxypregna-5,16-dien-20-one 3-propionate
TL;DR: 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate (CAS 3285-87-8) is a chemical compound with molecular formula C24H34O3 and molecular weight 370.25 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-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate
Also Known As: KST-1A3927, 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate, 20-Oxopregna-5,16-dien-3-yl propanoate, (3, A)-20-oxopregna-5,16-dien-3-yl propanoate
| Molecular Formula | C24H34O3 |
|---|---|
| Molecular Weight | 370.25 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.2508 |
| Heavy Atoms | 27 |
| Complexity | 717.0 |
Chemical Identifiers
| CAS Number | 3285-87-8 |
|---|---|
| SMILES | CCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC=C4C(=O)C)C)C |
| InChIKey | HGXGILYYMJORSA-GBOSRWDWSA-N |
Product Overview
3beta-Hydroxypregna-5,16-dien-20-one 3-propionate (CAS 3285-87-8), with molecular formula C24H34O3 and molecular weight 370.25 g/mol. IUPAC: [(3S,8R,9S,10R,13S,14S)-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate.
Chemical Property Profile of 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate
Property Insights of 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate
The XLogP value of 5.0 indicates that 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate 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 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate?
The CAS number of 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate is 3285-87-8.
What is the molecular formula of 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate?
The molecular formula of 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate is C24H34O3.
What is the molecular weight of 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate?
The molecular weight of 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate is 370.25 g/mol.
Where can I buy 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate?
You can request a quote for 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate?
Yes, KEHONG BIO provides custom synthesis services for 3beta-Hydroxypregna-5,16-dien-20-one 3-propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.