2-羟亚甲基孕酮
TL;DR: 2-羟亚甲基孕酮 (CAS 1452-25-1) is a chemical compound with molecular formula C22H30O3 and molecular weight 342.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-羟亚甲基孕酮
(8S,9S,10R,13S,14S,17S)-17-acetyl-2-(hydroxymethylidene)-10,13-dimethyl-6,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: 2-Hydroxymethyleneprogesterone
| Molecular Formula | C22H30O3 |
|---|---|
| Molecular Weight | 342.22 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 342.21948 |
| Heavy Atoms | 25 |
| Complexity | 687.0 |
Chemical Identifiers
| CAS Number | 1452-25-1 |
|---|---|
| SMILES | CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)C(=CO)C[C@]34C)C |
| InChIKey | MRMWKDZMKGYFIR-KPYMMKSZSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-羟亚甲基孕酮 (CAS 1452-25-1), with molecular formula C22H30O3 and molecular weight 342.22 g/mol. IUPAC: (8S,9S,10R,13S,14S,17S)-17-acetyl-2-(hydroxymethylidene)-10,13-dimethyl-6,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 2-羟亚甲基孕酮
Property Insights of 2-羟亚甲基孕酮
The XLogP value of 4.3 indicates that 2-羟亚甲基孕酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 2-羟亚甲基孕酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-羟亚甲基孕酮 has 1 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 2-羟亚甲基孕酮?
The CAS number of 2-羟亚甲基孕酮 is 1452-25-1.
What is the molecular formula of 2-羟亚甲基孕酮?
The molecular formula of 2-羟亚甲基孕酮 is C22H30O3.
What is the molecular weight of 2-羟亚甲基孕酮?
The molecular weight of 2-羟亚甲基孕酮 is 342.22 g/mol.
Where can I buy 2-羟亚甲基孕酮?
You can request a quote for 2-羟亚甲基孕酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-羟亚甲基孕酮?
Yes, KEHONG BIO provides custom synthesis services for 2-羟亚甲基孕酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.