2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine
TL;DR: 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine (CAS 165542-15-4) is a chemical compound with molecular formula C6H10N2O3 and molecular weight 158.06914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-hydroxy-2-methyl-1,4,5,6-tetrahydropyrimidine-6-carboxylic acid
Also Known As: Hydroxyectoine, Hydroxyectoin, Thp(A), 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine, 5-hydroxy-2-methyl-1,4,5,6-tetrahydropyrimidine-6-carboxylic acid
Technical Specifications
| Molecular Formula | C6H10N2O3 |
| Molecular Weight | 158.06914 g/mol |
| XLogP | -1.2 |
| Topological Polar Surface Area (TPSA) | 81.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 158.06914 Da |
| Heavy Atoms | 11 |
| Complexity | 202.0 |
| SMILES | CC1=NCC(C(N1)C(=O)O)O |
| InChIKey | KIIBBJKLKFTNQO-UHFFFAOYSA-N |
Chemical Property Profile of 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine
Property Insights of 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine
The XLogP value of -1.2 indicates that 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine. Following Lipinski's Rule of Five, 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine?
The CAS number of 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine is 165542-15-4.
What is the molecular formula of 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine?
The molecular formula of 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine is C6H10N2O3.
What is the molecular weight of 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine?
The molecular weight of 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine is 158.06914 g/mol.
Where can I buy 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine?
You can request a quote for 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine?
Yes, CoreyChem provides custom synthesis services for 2-Methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.