ddMetCTP
TL;DR: ddMetCTP (CAS 136209-09-1) is a chemical compound with molecular formula C10H18N3O12P3 and molecular weight 465.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2S,5R)-5-(4-amino-5-methyl-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Also Known As: ddMetCTP, cytidine 5'-(tetrahydrogen triphosphate), 2',3'-dideoxy-5-methyl-, [[(2S,5R)-5-(4-amino-5-methyl-2-oxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate, [[(2S,5R)-5-(4-amino-5-methyl-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
| Molecular Formula | C10H18N3O12P3 |
|---|---|
| Molecular Weight | 465.01 g/mol |
| LogP | 0.15482 |
| Topological Polar Surface Area | 229.96 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 465.01035 |
| Heavy Atoms | 28 |
| Complexity | 927.961 |
Chemical Identifiers
| CAS Number | 136209-09-1 |
|---|---|
| SMILES | CC1=CN(C(=O)N=C1N)[C@H]2CC[C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O |
Product Overview
ddMetCTP (CAS 136209-09-1), with molecular formula C10H18N3O12P3 and molecular weight 465.01 g/mol. IUPAC: [[(2S,5R)-5-(4-amino-5-methyl-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.
Chemical Property Profile of ddMetCTP
Property Insights of ddMetCTP
The XLogP value of 0.15482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ddMetCTP. The TPSA of 229.96 Ų indicates high polarity, suggesting ddMetCTP may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ddMetCTP has 5 hydrogen bond donor(s) and 10 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 ddMetCTP?
The CAS number of ddMetCTP is 136209-09-1.
What is the molecular formula of ddMetCTP?
The molecular formula of ddMetCTP is C10H18N3O12P3.
What is the molecular weight of ddMetCTP?
The molecular weight of ddMetCTP is 465.01 g/mol.
Where can I buy ddMetCTP?
You can request a quote for ddMetCTP directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ddMetCTP?
Yes, KEHONG BIO provides custom synthesis services for ddMetCTP and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.