5-Propenyl-dutp
TL;DR: 5-Propenyl-dutp (CAS 79551-91-0) is a chemical compound with molecular formula C12H19N2O14P3 and molecular weight 508.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2R,5R)-5-[2,4-dioxo-5-[(E)-prop-1-enyl]pyrimidin-1-yl]-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Also Known As: 5-Propenyl-dutp, nPredUTP, E-5-Propenyl-dutp, [[(2R,5R)-5-[2,4-dioxo-5-[(E)-prop-1-enyl]pyrimidin-1-yl]-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate, Uridine, 5'-(tetrahydrogen triphosphate), 2'-deoxy-5-(1-propenyl)-, (E)-
| Molecular Formula | C12H19N2O14P3 |
|---|---|
| Molecular Weight | 508.00 g/mol |
| LogP | -0.4386 |
| Topological Polar Surface Area | 244.14 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 508.0049 |
| Heavy Atoms | 31 |
| Complexity | 1088.7473 |
Chemical Identifiers
| CAS Number | 79551-91-0 |
|---|---|
| SMILES | C/C=C/C1=CN(C(=O)NC1=O)[C@H]2CC([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O |
Product Overview
5-Propenyl-dutp (CAS 79551-91-0), with molecular formula C12H19N2O14P3 and molecular weight 508.00 g/mol. IUPAC: [[(2R,5R)-5-[2,4-dioxo-5-[(E)-prop-1-enyl]pyrimidin-1-yl]-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.
Chemical Property Profile of 5-Propenyl-dutp
Property Insights of 5-Propenyl-dutp
The XLogP value of -0.4386 indicates that 5-Propenyl-dutp is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 244.14 Ų indicates high polarity, suggesting 5-Propenyl-dutp may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-Propenyl-dutp has 6 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 5-Propenyl-dutp?
The CAS number of 5-Propenyl-dutp is 79551-91-0.
What is the molecular formula of 5-Propenyl-dutp?
The molecular formula of 5-Propenyl-dutp is C12H19N2O14P3.
What is the molecular weight of 5-Propenyl-dutp?
The molecular weight of 5-Propenyl-dutp is 508.00 g/mol.
Where can I buy 5-Propenyl-dutp?
You can request a quote for 5-Propenyl-dutp directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Propenyl-dutp?
Yes, KEHONG BIO provides custom synthesis services for 5-Propenyl-dutp and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.