Utonex
TL;DR: Utonex (CAS 78920-52-2) is a chemical compound with molecular formula C33H36N4O8S and molecular weight 648.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Utonex
(8R,9S,13S,14S)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol;N-[3-(5-nitrofuran-2-yl)-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazin-6-yl]acetamide
Also Known As: Utonex, (8R,9S,13S,14S)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol;N-[3-(5-nitrofuran-2-yl)-1,1-dioxo-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazin-6-yl]acetamide, 19-Norpregna-1,3,5(10)-trien-20-yne-3,17-diol, (17alpha)-, mixt. with N-(3,4-dihydro-3-(5-nitro-2-furanyl)-2H-1,2,4-benzothiadiazin-6-yl)acetamide S,S-dioxide, (8R,9S,13S,14S)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol; N-[3-(5-nitrofuran-2-yl)-1,1-dioxo-3,4-dihydro-2H-1, N-[3-(5-Nitrofuran-2-yl)-1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-6-yl]ethanimidic acid--(17xi)-19-norpregna-1(10),2,4-trien-20-yne-3,17-diol (1/1)
| Molecular Formula | C33H36N4O8S |
|---|---|
| Molecular Weight | 648.23 g/mol |
| LogP | 5.1614 |
| Topological Polar Surface Area | 195.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 648.2254 |
| Heavy Atoms | 46 |
| Complexity | 1120.0 |
Chemical Identifiers
| CAS Number | 78920-52-2 |
|---|---|
| SMILES | CC(=O)NC1=CC2=C(C=C1)S(=O)(=O)NC(N2)C3=CC=C(O3)[N+](=O)[O-].C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2(C#C)O)CCC4=C3C=CC(=C4)O |
| InChIKey | XYYCDDMINWATHW-ZQISRJICSA-N |
Product Overview
Utonex (CAS 78920-52-2), with molecular formula C33H36N4O8S and molecular weight 648.23 g/mol. IUPAC: (8R,9S,13S,14S)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol;N-[3-(5-nitrofuran-2-yl)-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazin-6-yl]acetamide.
Chemical Property Profile of Utonex
Property Insights of Utonex
The XLogP value of 5.1614 indicates that Utonex is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 195.0 Ų indicates high polarity, suggesting Utonex may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Utonex has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Utonex?
The CAS number of Utonex is 78920-52-2.
What is the molecular formula of Utonex?
The molecular formula of Utonex is C33H36N4O8S.
What is the molecular weight of Utonex?
The molecular weight of Utonex is 648.23 g/mol.
Where can I buy Utonex?
You can request a quote for Utonex directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Utonex?
Yes, KEHONG BIO provides custom synthesis services for Utonex and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.