Pentopyranine A
TL;DR: Pentopyranine A (CAS 51130-02-0) is a chemical compound with molecular formula C9H13N3O3 and molecular weight 211.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-1-[(2R,5R)-5-hydroxyoxan-2-yl]pyrimidin-2-one
Also Known As: Pentopyranine A, 1-(2,3-Dideoxy-alpha-L-glycero-pentopyranosyl)cytosine, 4-amino-1-[(2R,5R)-5-hydroxyoxan-2-yl]pyrimidin-2-one, 4-amino-1-[(2r,5r)-5-hydroxytetrahydro-2h-pyran-2-yl]pyrimidin-2(1h)-one, 1-(5-Hydroxyoxan-2-yl)-4-imino-1,4-dihydropyrimidin-2-ol
| Molecular Formula | C9H13N3O3 |
|---|---|
| Molecular Weight | 211.10 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 88.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 211.09569 |
| Heavy Atoms | 15 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 51130-02-0 |
|---|---|
| SMILES | C1C[C@@H](OC[C@@H]1O)N2C=CC(=NC2=O)N |
| InChIKey | RQQDLJNLFGVCKQ-HTRCEHHLSA-N |
Product Overview
Pentopyranine A (CAS 51130-02-0), with molecular formula C9H13N3O3 and molecular weight 211.10 g/mol. IUPAC: 4-amino-1-[(2R,5R)-5-hydroxyoxan-2-yl]pyrimidin-2-one.
Chemical Property Profile of Pentopyranine A
Property Insights of Pentopyranine A
The XLogP value of -1.3 indicates that Pentopyranine A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 88.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Pentopyranine A. Following Lipinski's Rule of Five, Pentopyranine A has 2 hydrogen bond donor(s) and 3 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 Pentopyranine A?
The CAS number of Pentopyranine A is 51130-02-0.
What is the molecular formula of Pentopyranine A?
The molecular formula of Pentopyranine A is C9H13N3O3.
What is the molecular weight of Pentopyranine A?
The molecular weight of Pentopyranine A is 211.10 g/mol.
Where can I buy Pentopyranine A?
You can request a quote for Pentopyranine A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentopyranine A?
Yes, KEHONG BIO provides custom synthesis services for Pentopyranine A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.