(3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate
TL;DR: (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate (CAS 152-19-2) is a chemical compound with molecular formula C15H16N3O8P and molecular weight 397.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,5R)-2-(hydroxymethyl)-5-(7-hydroxy-1-oxopyrimido[1,6-a]benzimidazol-2-yl)oxolan-3-yl] dihydrogen phosphate
Also Known As: HBDCP, p-BQ-Dcp, (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate, (3/'-hydroxy)-3,N(4)-benzetheno-1/'-deoxycytidine 3/'-phosphate, [(2R,3S,5R)-2-(hydroxymethyl)-5-(7-hydroxy-1-oxopyrimido[1,6-a]benzimidazol-2-yl)oxolan-3-yl] dihydrogen phosphate
| Molecular Formula | C15H16N3O8P |
|---|---|
| Molecular Weight | 397.07 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.0675 |
| Heavy Atoms | 27 |
| Complexity | 671.0 |
Chemical Identifiers
| CAS Number | 152-19-2 |
|---|---|
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=CC3=NC4=C(N3C2=O)C=CC(=C4)O)CO)OP(=O)(O)O |
| InChIKey | JJJAJFXQFVWTCD-OUCADQQQSA-N |
Product Overview
(3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate (CAS 152-19-2), with molecular formula C15H16N3O8P and molecular weight 397.07 g/mol. IUPAC: [(2R,3S,5R)-2-(hydroxymethyl)-5-(7-hydroxy-1-oxopyrimido[1,6-a]benzimidazol-2-yl)oxolan-3-yl] dihydrogen phosphate.
Chemical Property Profile of (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate
Property Insights of (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate
The XLogP value of -1.0 indicates that (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 155.0 Ų indicates high polarity, suggesting (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate has 4 hydrogen bond donor(s) and 9 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 (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate?
The CAS number of (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate is 152-19-2.
What is the molecular formula of (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate?
The molecular formula of (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate is C15H16N3O8P.
What is the molecular weight of (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate?
The molecular weight of (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate is 397.07 g/mol.
Where can I buy (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate?
You can request a quote for (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate?
Yes, KEHONG BIO provides custom synthesis services for (3'-Hydroxy)-3,N(4)-benzetheno-1'-deoxycytidine 3'-phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.