U 72745G
TL;DR: U 72745G (CAS 39964-51-7) is a chemical compound with molecular formula C22H29FO4 and molecular weight 376.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6S,8S,10R,13S,14S,16R,17R)-6-fluoro-17-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: U 72745G, U-72745G, U-72,745G, Pregna-4,9(11)-diene-3,20-dione, 6-fluoro-17,21-dihydroxy-16-methyl-, (6alpha,16alpha)-, U-42129
| Molecular Formula | C22H29FO4 |
|---|---|
| Molecular Weight | 376.20 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 376.205 |
| Heavy Atoms | 27 |
| Complexity | 770.0 |
Chemical Identifiers
| CAS Number | 39964-51-7 |
|---|---|
| SMILES | C[C@@H]1C[C@H]2[C@@H]3C[C@@H](C4=CC(=O)CC[C@@]4(C3=CC[C@@]2([C@]1(C(=O)CO)O)C)C)F |
| InChIKey | MUEOUHRWNRABSW-XUOSUNSOSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
U 72745G (CAS 39964-51-7), with molecular formula C22H29FO4 and molecular weight 376.20 g/mol. IUPAC: (6S,8S,10R,13S,14S,16R,17R)-6-fluoro-17-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of U 72745G
Property Insights of U 72745G
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for U 72745G. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for U 72745G. Following Lipinski's Rule of Five, U 72745G has 2 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 U 72745G?
The CAS number of U 72745G is 39964-51-7.
What is the molecular formula of U 72745G?
The molecular formula of U 72745G is C22H29FO4.
What is the molecular weight of U 72745G?
The molecular weight of U 72745G is 376.20 g/mol.
Where can I buy U 72745G?
You can request a quote for U 72745G directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for U 72745G?
Yes, KEHONG BIO provides custom synthesis services for U 72745G and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.