2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one
TL;DR: 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one (CAS 296770-22-4) is a chemical compound with molecular formula C15H12ClN3O and molecular weight 285.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1-one
Also Known As: 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1-one, 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one, BAS 01172727, 2-(2-amino-5-chlorophenyl)-4-methyl-1(2H)-phthalazinone, 2-(2-amino-5-chlorophenyl)-4-methyl-1-phthalazinone
| Molecular Formula | C15H12ClN3O |
|---|---|
| Molecular Weight | 285.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 58.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 285.0669 |
| Heavy Atoms | 20 |
| Complexity | 425.0 |
Chemical Identifiers
| CAS Number | 296770-22-4 |
|---|---|
| SMILES | CC1=NN(C(=O)C2=CC=CC=C12)C3=C(C=CC(=C3)Cl)N |
| InChIKey | LDFAYUKOEJXLIS-UHFFFAOYSA-N |
Product Overview
2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one (CAS 296770-22-4), with molecular formula C15H12ClN3O and molecular weight 285.07 g/mol. IUPAC: 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1-one.
Chemical Property Profile of 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one
Property Insights of 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one. With a topological polar surface area (TPSA) of 58.7 Ų, 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one has 1 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-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one?
The CAS number of 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one is 296770-22-4.
What is the molecular formula of 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one?
The molecular formula of 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one is C15H12ClN3O.
What is the molecular weight of 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one?
The molecular weight of 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one is 285.07 g/mol.
Where can I buy 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one?
You can request a quote for 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-amino-5-chlorophenyl)-4-methylphthalazin-1(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.