2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione
TL;DR: 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione (CAS 73972-89-1) is a chemical compound with molecular formula C11H9IN2O3 and molecular weight 343.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-iodoacetyl)-3-methylphthalazine-1,4-dione
Also Known As: 2-Iodoacetyl-3-methyl-1,4-phthalazinedione, 1,4-Phthalazinedione, 2-iodoacetyl-3-methyl-, 2-(2-iodoacetyl)-3-methylphthalazine-1,4-dione, 5-(2-iodoacetyl)-3-methyl-2H-phthalazine-1,4-dione, 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione
| Molecular Formula | C11H9IN2O3 |
|---|---|
| Molecular Weight | 343.97 g/mol |
| LogP | 0.7754 |
| Topological Polar Surface Area | 61.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 343.9658 |
| Heavy Atoms | 17 |
| Complexity | 714.7088 |
Chemical Identifiers
| CAS Number | 73972-89-1 |
|---|---|
| SMILES | CN1C(=O)C2=CC=CC=C2C(=O)N1C(=O)CI |
Product Overview
2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione (CAS 73972-89-1), with molecular formula C11H9IN2O3 and molecular weight 343.97 g/mol. IUPAC: 2-(2-iodoacetyl)-3-methylphthalazine-1,4-dione.
Chemical Property Profile of 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione
Property Insights of 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione
The XLogP value of 0.7754 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione. The TPSA of 61.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione. Following Lipinski's Rule of Five, 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione has 0 hydrogen bond donor(s) and 3 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 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione?
The CAS number of 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione is 73972-89-1.
What is the molecular formula of 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione?
The molecular formula of 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione is C11H9IN2O3.
What is the molecular weight of 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione?
The molecular weight of 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione is 343.97 g/mol.
Where can I buy 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione?
You can request a quote for 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(Iodoacetyl)-3-methyl-2,3-dihydrophthalazine-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.