![5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine structure](/static/products/176/176587-48-7.png)
5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine
TL;DR: 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine (CAS 176587-48-7) is a chemical compound with molecular formula C17H17N3O6S and molecular weight 391.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-4-[[(2S,5R)-5-(2,4-dioxo-5-thiophen-2-ylpyrimidin-1-yl)oxolan-2-yl]methylamino]-4-oxobut-2-enoic acid
Also Known As: 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine, uridine, 5'-[(3-carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)-, (Z)-4-[[(2S,5R)-5-(2,4-dioxo-5-thiophen-2-ylpyrimidin-1-yl)oxolan-2-yl]methylamino]-4-oxobut-2-enoic acid, (Z)-4-[[(2S,5R)-5-[2,4-dioxo-5-(2-thienyl)pyrimidin-1-yl]tetrahydrofuran-2-yl]methylamino]-4-oxo-but-2-enoic acid, 2-Butenoic acid, 4-[[[(2S,5R)-5-[3,4-dihydro-2,4-dioxo-5-(2-thienyl)-1(2H)-pyrimidinyl]tetrahydro-2-furanyl]methyl]amino]-4-oxo-, (2Z)-
| Molecular Formula | C17H17N3O6S |
|---|---|
| Molecular Weight | 391.08 g/mol |
| LogP | 0.6997 |
| Topological Polar Surface Area | 130.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 391.0838 |
| Heavy Atoms | 27 |
| Complexity | 975.2952 |
Chemical Identifiers
| CAS Number | 176587-48-7 |
|---|---|
| SMILES | C1C[C@@H](O[C@@H]1CNC(=O)/C=C\C(=O)O)N2C=C(C(=O)NC2=O)C3=CC=CS3 |
Product Overview
5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine (CAS 176587-48-7), with molecular formula C17H17N3O6S and molecular weight 391.08 g/mol. IUPAC: (Z)-4-[[(2S,5R)-5-(2,4-dioxo-5-thiophen-2-ylpyrimidin-1-yl)oxolan-2-yl]methylamino]-4-oxobut-2-enoic acid.
Chemical Property Profile of 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine
Property Insights of 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine
The XLogP value of 0.6997 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine. The TPSA of 130.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine. Following Lipinski's Rule of Five, 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine has 3 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 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine?
The CAS number of 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine is 176587-48-7.
What is the molecular formula of 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine?
The molecular formula of 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine is C17H17N3O6S.
What is the molecular weight of 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine?
The molecular weight of 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine is 391.08 g/mol.
Where can I buy 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine?
You can request a quote for 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine?
Yes, KEHONG BIO provides custom synthesis services for 5'-[(3-Carboxy-1-oxo-2-propenyl)amino]-2',3',5'-trideoxy-5-(2-thienyl)-(Z)uridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.