17alpha-Hydroxyprogesterone 3-caproate 17-acetate
TL;DR: 17alpha-Hydroxyprogesterone 3-caproate 17-acetate (CAS 89202-94-8) is a chemical compound with molecular formula C29H42O5 and molecular weight 470.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,8R,9S,10R,13S,14S,17R)-17-acetyl-17-acetyloxy-10,13-dimethyl-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-yl] hexanoate
Also Known As: 17alpha-Hydroxyprogesterone 3-caproate 17-acetate, 17-(Acetyloxy)-20-oxopregna-4,6-dien-3-yl hexanoate, 17-(Acetyloxy)-20-oxopregna-4,6-dien-3beta-yl hexanoate, [(3S,8R,9S,10R,13S,14S,17R)-17-acetyl-17-acetyloxy-10,13-dimethyl-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-yl] hexanoate
| Molecular Formula | C29H42O5 |
|---|---|
| Molecular Weight | 470.30 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 470.30322 |
| Heavy Atoms | 34 |
| Complexity | 902.0 |
Chemical Identifiers
| CAS Number | 89202-94-8 |
|---|---|
| SMILES | CCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3C=CC2=C1)CC[C@@]4(C(=O)C)OC(=O)C)C)C |
| InChIKey | BXOAQGFWIMFYIT-KDYLXYANSA-N |
Product Overview
17alpha-Hydroxyprogesterone 3-caproate 17-acetate (CAS 89202-94-8), with molecular formula C29H42O5 and molecular weight 470.30 g/mol. IUPAC: [(3S,8R,9S,10R,13S,14S,17R)-17-acetyl-17-acetyloxy-10,13-dimethyl-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-yl] hexanoate.
Chemical Property Profile of 17alpha-Hydroxyprogesterone 3-caproate 17-acetate
Property Insights of 17alpha-Hydroxyprogesterone 3-caproate 17-acetate
The XLogP value of 5.8 indicates that 17alpha-Hydroxyprogesterone 3-caproate 17-acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 17alpha-Hydroxyprogesterone 3-caproate 17-acetate. Following Lipinski's Rule of Five, 17alpha-Hydroxyprogesterone 3-caproate 17-acetate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 17alpha-Hydroxyprogesterone 3-caproate 17-acetate?
The CAS number of 17alpha-Hydroxyprogesterone 3-caproate 17-acetate is 89202-94-8.
What is the molecular formula of 17alpha-Hydroxyprogesterone 3-caproate 17-acetate?
The molecular formula of 17alpha-Hydroxyprogesterone 3-caproate 17-acetate is C29H42O5.
What is the molecular weight of 17alpha-Hydroxyprogesterone 3-caproate 17-acetate?
The molecular weight of 17alpha-Hydroxyprogesterone 3-caproate 17-acetate is 470.30 g/mol.
Where can I buy 17alpha-Hydroxyprogesterone 3-caproate 17-acetate?
You can request a quote for 17alpha-Hydroxyprogesterone 3-caproate 17-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17alpha-Hydroxyprogesterone 3-caproate 17-acetate?
Yes, KEHONG BIO provides custom synthesis services for 17alpha-Hydroxyprogesterone 3-caproate 17-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.