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Pregnanolone structure
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Pregnanolone

TL;DR: Pregnanolone (CAS 128-20-1) is a chemical compound with molecular formula C21H34O2 and molecular weight 318.2559 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-[(3R,5R,8R,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone

Also Known As: Pregnanolone, Eltanolona, Eltanolonum, Pregnanolone II, Allopregnanolone

CAS Number
128-20-1
Molecular Formula
C21H34O2
Molecular Weight
318.2559 g/mol
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Application Areas

Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (15 patents) Analytical Reagents (14 patents) Biotechnology (25 patents) Catalysts (7 patents) Heterocyclic Building Blocks (106 patents)

Technical Specifications

Molecular FormulaC21H34O2
Molecular Weight318.2559 g/mol
XLogP4.9
Topological Polar Surface Area (TPSA)37.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds1
Exact Mass318.2559 Da
Heavy Atoms23
Complexity500.0
SMILESCC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C
InChIKeyAURFZBICLPNKBZ-YZRLXODZSA-N

Chemical Property Profile of Pregnanolone

XLogP
4.9
TPSA (Topological Polar Surface Area)
37.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
1
Heavy Atoms
23
Complexity
500.0
Exact Mass
318.2559
Monoisotopic Mass
318.2559
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Pregnanolone

The XLogP value of 4.9 indicates that Pregnanolone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Pregnanolone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pregnanolone has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Pregnanolone?

The CAS number of Pregnanolone is 128-20-1.

What is the molecular formula of Pregnanolone?

The molecular formula of Pregnanolone is C21H34O2.

What is the molecular weight of Pregnanolone?

The molecular weight of Pregnanolone is 318.2559 g/mol.

Where can I buy Pregnanolone?

You can request a quote for Pregnanolone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Pregnanolone?

Yes, CoreyChem provides custom synthesis services for Pregnanolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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