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ethisterone structure
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ethisterone

TL;DR: ethisterone (CAS 47165-57-1) is a chemical compound with molecular formula C21H28O2 and molecular weight 312.20892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(17R)-17-ethynyl-17-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one

Also Known As: ethisterone, Aethisteronum, Pregneninolone, Syngestrotabs, Aethisteron

CAS Number
47165-57-1
Molecular Formula
C21H28O2
Molecular Weight
312.20892 g/mol
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Technical Specifications

Molecular FormulaC21H28O2
Molecular Weight312.20892 g/mol
XLogP3.5
Topological Polar Surface Area (TPSA)37.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds1
Exact Mass312.20892 Da
Heavy Atoms23
Complexity637.0
SMILESCC12CCC(=O)C=C1CCC3C2CCC4(C3CC[C@]4(C#C)O)C
InChIKeyCHNXZKVNWQUJIB-KQMXEUTGSA-N

Chemical Property Profile of ethisterone

XLogP
3.5
TPSA (Topological Polar Surface Area)
37.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
1
Heavy Atoms
23
Complexity
637.0
Exact Mass
312.20892
Monoisotopic Mass
312.20892
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 ethisterone

The XLogP value of 3.5 indicates that ethisterone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, ethisterone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethisterone 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 ethisterone?

The CAS number of ethisterone is 47165-57-1.

What is the molecular formula of ethisterone?

The molecular formula of ethisterone is C21H28O2.

What is the molecular weight of ethisterone?

The molecular weight of ethisterone is 312.20892 g/mol.

Where can I buy ethisterone?

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

Does CoreyChem offer custom synthesis for ethisterone?

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

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