Pseudoisocytidine
TL;DR: Pseudoisocytidine (CAS 59464-15-2) is a chemical compound with molecular formula C9H13N3O5 and molecular weight 243.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-pyrimidin-6-one
Also Known As: Pseudoisocytidine, psi-Isocytidine, Pseduoisocytidine, psi Icyd, 5-(beta-D-Ribofuranosyl)isocytosine
| Molecular Formula | C9H13N3O5 |
|---|---|
| Molecular Weight | 243.09 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 137.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.08553 |
| Heavy Atoms | 17 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 59464-15-2 |
|---|---|
| SMILES | C1=C(C(=O)NC(=N1)N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O |
| InChIKey | MPDKOGQMQLSNOF-GBNDHIKLSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pseudoisocytidine (CAS 59464-15-2), with molecular formula C9H13N3O5 and molecular weight 243.09 g/mol. IUPAC: 2-amino-5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-pyrimidin-6-one.
Chemical Property Profile of Pseudoisocytidine
Property Insights of Pseudoisocytidine
The XLogP value of -3.1 indicates that Pseudoisocytidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pseudoisocytidine. Following Lipinski's Rule of Five, Pseudoisocytidine has 5 hydrogen bond donor(s) and 6 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 Pseudoisocytidine?
The CAS number of Pseudoisocytidine is 59464-15-2.
What is the molecular formula of Pseudoisocytidine?
The molecular formula of Pseudoisocytidine is C9H13N3O5.
What is the molecular weight of Pseudoisocytidine?
The molecular weight of Pseudoisocytidine is 243.09 g/mol.
Where can I buy Pseudoisocytidine?
You can request a quote for Pseudoisocytidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudoisocytidine?
Yes, KEHONG BIO provides custom synthesis services for Pseudoisocytidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.