Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate
TL;DR: Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate (CAS 16015-52-4) is a chemical compound with molecular formula C11H10N2O3 and molecular weight 218.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-methyl-4-oxophthalazine-1-carboxylate
Also Known As: methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate, methyl 3-methyl-4-oxophthalazine-1-carboxylate, methyl 3-methyl-4-oxo-phthalazine-1-carboxylate, Methyl3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate, methyl 3-methyl-4-oxo-3,4-dihydro-1-phthalazinecarboxylate
| Molecular Formula | C11H10N2O3 |
|---|---|
| Molecular Weight | 218.07 g/mol |
| LogP | 0.7201 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.06914 |
| Heavy Atoms | 16 |
| Complexity | 616.14606 |
Chemical Identifiers
| CAS Number | 16015-52-4 |
|---|---|
| SMILES | CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC |
Product Overview
Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate (CAS 16015-52-4), with molecular formula C11H10N2O3 and molecular weight 218.07 g/mol. IUPAC: methyl 3-methyl-4-oxophthalazine-1-carboxylate.
Chemical Property Profile of Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate
Property Insights of Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate
The XLogP value of 0.7201 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate. Following Lipinski's Rule of Five, Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate has 0 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 Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate?
The CAS number of Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate is 16015-52-4.
What is the molecular formula of Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate?
The molecular formula of Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate is C11H10N2O3.
What is the molecular weight of Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate?
The molecular weight of Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate is 218.07 g/mol.
Where can I buy Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate?
You can request a quote for Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.