17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one
TL;DR: 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one (CAS 145624-22-2) is a chemical compound with molecular formula C21H27IO2 and molecular weight 438.1056 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(8R,9S,10R,13S,14S,17R)-17-hydroxy-17-[(E)-2-iodoethenyl]-10,13-dimethyl-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: 17-IE-Adoo, 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one, 17- androsta-4,6-dien-17-ol-3-one, 17alpha-(2-Iodoethenyl)androsta-4,6-dien-17beta-ol-3-one, (8R,9S,10R,13S,14S,17R)-17-hydroxy-17-[(E)-2-iodoethenyl]-10,13-dimethyl-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one
Technical Specifications
| Molecular Formula | C21H27IO2 |
| Molecular Weight | 438.1056 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 438.1056 Da |
| Heavy Atoms | 24 |
| Complexity | 663.0 |
| SMILES | C[C@]12CCC(=O)C=C1C=C[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(/C=C/I)O)C |
| InChIKey | BTQDHLNPKIOWIW-TWQPTUMUSA-N |
Chemical Property Profile of 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one
Property Insights of 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one
The XLogP value of 4.1 indicates that 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one?
The CAS number of 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one is 145624-22-2.
What is the molecular formula of 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one?
The molecular formula of 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one is C21H27IO2.
What is the molecular weight of 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one?
The molecular weight of 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one is 438.1056 g/mol.
Where can I buy 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one?
You can request a quote for 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one?
Yes, CoreyChem provides custom synthesis services for 17-(2-Iodoethenyl)androsta-4,6-dien-17-ol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.