Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)-
TL;DR: Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)- (CAS 53-40-7) is a chemical compound with molecular formula C25H41NO3 and molecular weight 403.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2S,3S,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2-morpholin-4-yl-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: KST-1A5700, 3-Hydroxy-2-(morpholin-4-yl)pregnan-20-one, 3-alpha-Hydroxy-2-beta-morpholino-5-alpha-pregnan-20-one, (2, A,3
| Molecular Formula | C25H41NO3 |
|---|---|
| Molecular Weight | 403.31 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 403.30865 |
| Heavy Atoms | 29 |
| Complexity | 646.0 |
Chemical Identifiers
| CAS Number | 53-40-7 |
|---|---|
| SMILES | CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(C[C@@H]([C@H](C4)O)N5CCOCC5)C)C |
| InChIKey | VXJUXGFZTAASGS-NDSOISQZSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)- (CAS 53-40-7), with molecular formula C25H41NO3 and molecular weight 403.31 g/mol. IUPAC: 1-[(2S,3S,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2-morpholin-4-yl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone.
Chemical Property Profile of Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)-
Property Insights of Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)-
The XLogP value of 4.2 indicates that Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)- 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 Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)-?
The CAS number of Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)- is 53-40-7.
What is the molecular formula of Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)-?
The molecular formula of Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)- is C25H41NO3.
What is the molecular weight of Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)-?
The molecular weight of Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)- is 403.31 g/mol.
Where can I buy Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)-?
You can request a quote for Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)-?
Yes, KEHONG BIO provides custom synthesis services for Pregnan-20-one, 3-hydroxy-2-(4-morpholinyl)-, (2beta,3alpha,5alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.