Deoxycytidine thiotriphosphate
TL;DR: Deoxycytidine thiotriphosphate (CAS 80951-76-4) is a chemical compound with molecular formula C9H16N3O12P3S and molecular weight 482.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2R,3S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl] phosphono hydrogen phosphate
Also Known As: Dctpalphas, DCTTP, Alpha Thiol dCTP, dCTP-alpha-S, Sp-dCTP.alpha.S
| Molecular Formula | C9H16N3O12P3S |
|---|---|
| Molecular Weight | 482.97 g/mol |
| LogP | -3.9 |
| Topological Polar Surface Area | 263.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 8 |
| Exact Mass | 482.96677 |
| Heavy Atoms | 28 |
| Complexity | 828.0 |
Chemical Identifiers
| CAS Number | 80951-76-4 |
|---|---|
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=CC(=NC2=O)N)COP(=S)(O)OP(=O)(O)OP(=O)(O)O)O |
| InChIKey | CBYOGVVSAABFCZ-JURLQNGUSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Deoxycytidine thiotriphosphate (CAS 80951-76-4), with molecular formula C9H16N3O12P3S and molecular weight 482.97 g/mol. IUPAC: [[(2R,3S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl] phosphono hydrogen phosphate.
Chemical Property Profile of Deoxycytidine thiotriphosphate
Property Insights of Deoxycytidine thiotriphosphate
The XLogP value of -3.9 indicates that Deoxycytidine thiotriphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 263.0 Ų indicates high polarity, suggesting Deoxycytidine thiotriphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Deoxycytidine thiotriphosphate has 6 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Deoxycytidine thiotriphosphate?
The CAS number of Deoxycytidine thiotriphosphate is 80951-76-4.
What is the molecular formula of Deoxycytidine thiotriphosphate?
The molecular formula of Deoxycytidine thiotriphosphate is C9H16N3O12P3S.
What is the molecular weight of Deoxycytidine thiotriphosphate?
The molecular weight of Deoxycytidine thiotriphosphate is 482.97 g/mol.
Where can I buy Deoxycytidine thiotriphosphate?
You can request a quote for Deoxycytidine thiotriphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deoxycytidine thiotriphosphate?
Yes, KEHONG BIO provides custom synthesis services for Deoxycytidine thiotriphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.