![Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate structure](/static/products/7369/736963-78-3.webp)
Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate
TL;DR: Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate (CAS 736963-78-3) is a chemical compound with molecular formula C18H16N4O6S and molecular weight 416.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate
Also Known As: methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate, Methyl 2-[[(3-methyl-4-oxo-phthalazine-1-carbonyl)amino]sulfamoyl]benzoate, Methyl 2-[2-(3-methyl-4-oxo-3,4-dihydrophthalazine-1-carbonyl)hydrazinesulfonyl]benzoate
| Molecular Formula | C18H16N4O6S |
|---|---|
| Molecular Weight | 416.08 g/mol |
| LogP | 0.3434 |
| Topological Polar Surface Area | 136.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 416.07904 |
| Heavy Atoms | 29 |
| Complexity | 1282.9961 |
Chemical Identifiers
| CAS Number | 736963-78-3 |
|---|---|
| SMILES | CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNS(=O)(=O)C3=CC=CC=C3C(=O)OC |
Product Overview
Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate (CAS 736963-78-3), with molecular formula C18H16N4O6S and molecular weight 416.08 g/mol. IUPAC: methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate.
Chemical Property Profile of Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate
Property Insights of Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate
The XLogP value of 0.3434 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate. The TPSA of 136.46 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate. Following Lipinski's Rule of Five, Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate has 2 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 Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate?
The CAS number of Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate is 736963-78-3.
What is the molecular formula of Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate?
The molecular formula of Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate is C18H16N4O6S.
What is the molecular weight of Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate?
The molecular weight of Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate is 416.08 g/mol.
Where can I buy Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate?
You can request a quote for Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]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-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[[(3-methyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.