硫酸孕烯醇酮
TL;DR: 硫酸孕烯醇酮 (CAS 1247-64-9) is a chemical compound with molecular formula C21H32O5S and molecular weight 396.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫酸孕烯醇酮
(17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl) hydrogen sulfate
Also Known As: pregnenolone sulfate, Pregnenolone sulfate sodium salt, (17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl) hydrogen sulfate
| Molecular Formula | C21H32O5S |
|---|---|
| Molecular Weight | 396.20 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 89.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 396.19705 |
| Heavy Atoms | 27 |
| Complexity | 766.0 |
Chemical Identifiers
| CAS Number | 1247-64-9 |
|---|---|
| SMILES | CC(=O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OS(=O)(=O)O)C)C |
| InChIKey | DIJBBUIOWGGQOP-UHFFFAOYSA-N |
Product Overview
硫酸孕烯醇酮 (CAS 1247-64-9), with molecular formula C21H32O5S and molecular weight 396.20 g/mol. IUPAC: (17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl) hydrogen sulfate.
Chemical Property Profile of 硫酸孕烯醇酮
Property Insights of 硫酸孕烯醇酮
The XLogP value of 3.8 indicates that 硫酸孕烯醇酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 硫酸孕烯醇酮. Following Lipinski's Rule of Five, 硫酸孕烯醇酮 has 1 hydrogen bond donor(s) and 5 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 硫酸孕烯醇酮?
The CAS number of 硫酸孕烯醇酮 is 1247-64-9.
What is the molecular formula of 硫酸孕烯醇酮?
The molecular formula of 硫酸孕烯醇酮 is C21H32O5S.
What is the molecular weight of 硫酸孕烯醇酮?
The molecular weight of 硫酸孕烯醇酮 is 396.20 g/mol.
Where can I buy 硫酸孕烯醇酮?
You can request a quote for 硫酸孕烯醇酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫酸孕烯醇酮?
Yes, KEHONG BIO provides custom synthesis services for 硫酸孕烯醇酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.