methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy-
TL;DR: methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy- (CAS 1104-01-4) is a chemical compound with molecular formula C22H29FO5 and molecular weight 392.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy-10,13-dimethyl-3,11-dioxo-2,4,6,7,8,9,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ylidene]acetate
Also Known As: methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy-
| Molecular Formula | C22H29FO5 |
|---|---|
| Molecular Weight | 392.20 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 392.1999 |
| Heavy Atoms | 28 |
| Complexity | 775.0 |
Chemical Identifiers
| CAS Number | 1104-01-4 |
|---|---|
| SMILES | C[C@]12CCC(=O)C[C@@]1([C@@H](C[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CCC4=CC(=O)OC)C)F)O |
| InChIKey | AHLOUXATKVXJKD-VYKWDCGESA-N |
Product Overview
methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy- (CAS 1104-01-4), with molecular formula C22H29FO5 and molecular weight 392.20 g/mol. IUPAC: methyl 2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy-10,13-dimethyl-3,11-dioxo-2,4,6,7,8,9,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ylidene]acetate.
Chemical Property Profile of methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy-
Property Insights of methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy-. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy-. Following Lipinski's Rule of Five, methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy- has 1 hydrogen bond donor(s) and 6 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 methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy-?
The CAS number of methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy- is 1104-01-4.
What is the molecular formula of methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy-?
The molecular formula of methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy- is C22H29FO5.
What is the molecular weight of methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy-?
The molecular weight of methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy- is 392.20 g/mol.
Where can I buy methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy-?
You can request a quote for methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy-?
Yes, KEHONG BIO provides custom synthesis services for methyl (2E)-2-[(5R,6R,8S,9S,10R,13S,14S)-6-fluoro-5-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.