Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)-
TL;DR: Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)- (CAS 82858-45-5) is a chemical compound with molecular formula C21H36ClNO2 and molecular weight 369.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3R,5S,8R,9S,10S,13S,14S,17R)-3-amino-17-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-yl]ethanone;hydrochloride
Also Known As: (3-alpha,5-alpha)-3-Aminopregnan-20-one 17-hydroxy- hydrochloride, Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)-, 3-alpha-Amino-17-alpha-hydroxy (5-alpha) pregnan 20-one hydrochloride, 3-Amino-17-hydroxypregnan-20-one--hydrogen chloride (1/1), (3-alpha,5-alpha)-3-Aminopregnan-20-one 17-hydroxy-hydrochloride
| Molecular Formula | C21H36ClNO2 |
|---|---|
| Molecular Weight | 369.24 g/mol |
| LogP | 4.0983 |
| Topological Polar Surface Area | 63.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 369.24347 |
| Heavy Atoms | 25 |
| Complexity | 554.01416 |
Chemical Identifiers
| CAS Number | 82858-45-5 |
|---|---|
| SMILES | CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@H](C4)N)C)C)O.Cl |
Product Overview
Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)- (CAS 82858-45-5), with molecular formula C21H36ClNO2 and molecular weight 369.24 g/mol. IUPAC: 1-[(3R,5S,8R,9S,10S,13S,14S,17R)-3-amino-17-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-yl]ethanone;hydrochloride.
Chemical Property Profile of Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)-
Property Insights of Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)-
The XLogP value of 4.0983 indicates that Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.32 Ų falls within the moderate polarity range, balancing permeability and solubility for Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)-. Following Lipinski's Rule of Five, Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)- has 2 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 Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)-?
The CAS number of Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)- is 82858-45-5.
What is the molecular formula of Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)-?
The molecular formula of Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)- is C21H36ClNO2.
What is the molecular weight of Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)-?
The molecular weight of Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)- is 369.24 g/mol.
Where can I buy Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)-?
You can request a quote for Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)- 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-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)-?
Yes, KEHONG BIO provides custom synthesis services for Pregnan-20-one, 3-amino-, 17-hydroxy-, hydrochloride, (3-alpha,5-alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.