Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate
TL;DR: Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate (CAS 499190-70-4) is a chemical compound with molecular formula C13H13N3O6S and molecular weight 339.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)sulfonylamino]benzoate
Also Known As: methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate, Methyl 2-[(4-methyl-2,6-dioxo-3H-pyrimidin-5-yl)sulfonylamino]benzoate, methyl 2-[(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)sulfonylamino]benzoate, methyl 2-{[(2,4-dihydroxy-6-methylpyrimidin-5-yl)sulfonyl]amino}benzoate, METHYL 2-(2-HYDROXY-4-METHYL-6-OXO-1,6-DIHYDROPYRIMIDINE-5-SULFONAMIDO)BENZOATE
| Molecular Formula | C13H13N3O6S |
|---|---|
| Molecular Weight | 339.05 g/mol |
| LogP | -0.04098 |
| Topological Polar Surface Area | 138.19 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.05252 |
| Heavy Atoms | 23 |
| Complexity | 973.68976 |
Chemical Identifiers
| CAS Number | 499190-70-4 |
|---|---|
| SMILES | CC1=C(C(=O)NC(=O)N1)S(=O)(=O)NC2=CC=CC=C2C(=O)OC |
Product Overview
Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate (CAS 499190-70-4), with molecular formula C13H13N3O6S and molecular weight 339.05 g/mol. IUPAC: methyl 2-[(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)sulfonylamino]benzoate.
Chemical Property Profile of Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate
Property Insights of Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate
The XLogP value of -0.04098 indicates that Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 138.19 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate. Following Lipinski's Rule of Five, Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate has 3 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 Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate?
The CAS number of Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate is 499190-70-4.
What is the molecular formula of Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate?
The molecular formula of Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate is C13H13N3O6S.
What is the molecular weight of Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate?
The molecular weight of Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate is 339.05 g/mol.
Where can I buy Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate?
You can request a quote for Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.