17beta-Carbomethoxyandrost-5-en-3beta-ol
TL;DR: 17beta-Carbomethoxyandrost-5-en-3beta-ol (CAS 7351-08-8) is a chemical compound with molecular formula C21H32O3 and molecular weight 332.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (3S,8S,9S,10R,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylate
Also Known As: etienic acid methyl ester, 17beta-Carbomethoxyandrost-5-en-3beta-ol, Finasteride Impurity 51, 17, A-carbomethoxyandrost-5-en-3
| Molecular Formula | C21H32O3 |
|---|---|
| Molecular Weight | 332.24 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.23514 |
| Heavy Atoms | 24 |
| Complexity | 567.0 |
Chemical Identifiers
| CAS Number | 7351-08-8 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)OC)CC=C4[C@@]3(CC[C@@H](C4)O)C |
| InChIKey | WGYHVQYXJNPQAA-WPWXJNKXSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
17beta-Carbomethoxyandrost-5-en-3beta-ol (CAS 7351-08-8), with molecular formula C21H32O3 and molecular weight 332.24 g/mol. IUPAC: methyl (3S,8S,9S,10R,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylate.
Chemical Property Profile of 17beta-Carbomethoxyandrost-5-en-3beta-ol
Property Insights of 17beta-Carbomethoxyandrost-5-en-3beta-ol
The XLogP value of 4.4 indicates that 17beta-Carbomethoxyandrost-5-en-3beta-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 17beta-Carbomethoxyandrost-5-en-3beta-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 17beta-Carbomethoxyandrost-5-en-3beta-ol 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 17beta-Carbomethoxyandrost-5-en-3beta-ol?
The CAS number of 17beta-Carbomethoxyandrost-5-en-3beta-ol is 7351-08-8.
What is the molecular formula of 17beta-Carbomethoxyandrost-5-en-3beta-ol?
The molecular formula of 17beta-Carbomethoxyandrost-5-en-3beta-ol is C21H32O3.
What is the molecular weight of 17beta-Carbomethoxyandrost-5-en-3beta-ol?
The molecular weight of 17beta-Carbomethoxyandrost-5-en-3beta-ol is 332.24 g/mol.
Where can I buy 17beta-Carbomethoxyandrost-5-en-3beta-ol?
You can request a quote for 17beta-Carbomethoxyandrost-5-en-3beta-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17beta-Carbomethoxyandrost-5-en-3beta-ol?
Yes, KEHONG BIO provides custom synthesis services for 17beta-Carbomethoxyandrost-5-en-3beta-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.