Probon acid
TL;DR: Probon acid (CAS 38252-10-7) is a chemical compound with molecular formula C12H18N2O7S and molecular weight 334.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Probon acid
1,6-dimethyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-1-ium-3-carboxylic acid;methyl sulfate
Also Known As: Probon acid, 3-carboxy-1,6-dimethyl-4-oxo-6,7,8,9-tetrahydro-4h-pyrido[1,2-a]pyrimidin-1-ium methyl sulfate, 4H-Pyrido(1,2-a)pyrimidinium, 6,7,8,9-tetrahydro-3-carboxy-1,6-dimethyl-4-oxo-, methyl sulfate, 6,7,8,9-Tetrahydro-3-carboxy-1,6-dimethyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium methyl sulfate, 1,6-dimethyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-1-ium-3-carboxylic acid,methyl sulfate
| Molecular Formula | C12H18N2O7S |
|---|---|
| Molecular Weight | 334.08 g/mol |
| LogP | -0.6387 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 334.08347 |
| Heavy Atoms | 22 |
| Complexity | 514.0 |
Chemical Identifiers
| CAS Number | 38252-10-7 |
|---|---|
| SMILES | CC1CCCC2=[N+](C=C(C(=O)N12)C(=O)O)C.COS(=O)(=O)[O-] |
| InChIKey | NDJXQSIBMZOJNL-UHFFFAOYSA-N |
Product Overview
Probon acid (CAS 38252-10-7), with molecular formula C12H18N2O7S and molecular weight 334.08 g/mol. IUPAC: 1,6-dimethyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-1-ium-3-carboxylic acid;methyl sulfate.
Chemical Property Profile of Probon acid
Property Insights of Probon acid
The XLogP value of -0.6387 indicates that Probon acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Probon acid. Following Lipinski's Rule of Five, Probon acid has 1 hydrogen bond donor(s) and 7 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 Probon acid?
The CAS number of Probon acid is 38252-10-7.
What is the molecular formula of Probon acid?
The molecular formula of Probon acid is C12H18N2O7S.
What is the molecular weight of Probon acid?
The molecular weight of Probon acid is 334.08 g/mol.
Where can I buy Probon acid?
You can request a quote for Probon acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Probon acid?
Yes, KEHONG BIO provides custom synthesis services for Probon acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.