CTK5F6330
TL;DR: CTK5F6330 (CAS 86163-17-9) is a chemical compound with molecular formula C13H16N2O7 and molecular weight 312.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]prop-2-enoate
Also Known As: 2-Propenoic acid,3-[1-(2-deoxy-b-D-erythro-pentofuranosyl)-1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl]-,methyl ester, (2E)-
| Molecular Formula | C13H16N2O7 |
|---|---|
| Molecular Weight | 312.10 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.09576 |
| Heavy Atoms | 22 |
| Complexity | 543.0 |
Chemical Identifiers
| CAS Number | 86163-17-9 |
|---|---|
| SMILES | COC(=O)C=CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)O |
| InChIKey | RKTRMSPWWLPPAY-IVZWLZJFSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CTK5F6330 (CAS 86163-17-9), with molecular formula C13H16N2O7 and molecular weight 312.10 g/mol. IUPAC: methyl 3-[1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]prop-2-enoate.
Chemical Property Profile of CTK5F6330
Property Insights of CTK5F6330
The XLogP value of -1.3 indicates that CTK5F6330 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK5F6330. Following Lipinski's Rule of Five, CTK5F6330 has 3 hydrogen bond donor(s) and 7 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 CTK5F6330?
The CAS number of CTK5F6330 is 86163-17-9.
What is the molecular formula of CTK5F6330?
The molecular formula of CTK5F6330 is C13H16N2O7.
What is the molecular weight of CTK5F6330?
The molecular weight of CTK5F6330 is 312.10 g/mol.
Where can I buy CTK5F6330?
You can request a quote for CTK5F6330 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5F6330?
Yes, KEHONG BIO provides custom synthesis services for CTK5F6330 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.