1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid
TL;DR: 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid (CAS 76877-03-7) is a chemical compound with molecular formula C9H11N3O4 and molecular weight 225.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid
Also Known As: 1-(carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid, 1-(Carbamoylamino)-2,4-dimethyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid
| Molecular Formula | C9H11N3O4 |
|---|---|
| Molecular Weight | 225.07 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 225.07495 |
| Heavy Atoms | 16 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 76877-03-7 |
|---|---|
| SMILES | CC1=CC(=O)N(C(=C1C(=O)O)C)NC(=O)N |
| InChIKey | NJPRSNJOAGYYMP-UHFFFAOYSA-N |
Product Overview
1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid (CAS 76877-03-7), with molecular formula C9H11N3O4 and molecular weight 225.07 g/mol. IUPAC: 1-(carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid.
Chemical Property Profile of 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid
Property Insights of 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid
The XLogP value of -1.1 indicates that 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid. Following Lipinski's Rule of Five, 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid 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
Frequently Asked Questions
What is the CAS number of 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid?
The CAS number of 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid is 76877-03-7.
What is the molecular formula of 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid?
The molecular formula of 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid is C9H11N3O4.
What is the molecular weight of 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid?
The molecular weight of 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid is 225.07 g/mol.
Where can I buy 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid?
You can request a quote for 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(Carbamoylamino)-2,4-dimethyl-6-oxopyridine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.