2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide
TL;DR: 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide (CAS 692279-46-2) is a chemical compound with molecular formula C21H23N3O4S and molecular weight 413.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide
Also Known As: 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide, 2-methyl-5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-N-((tetrahydrofuran-2-yl)methyl)benzenesulfonamide, 2-methyl-5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-N-(tetrahydrofuran-2-ylmethyl)benzenesulfonamide
| Molecular Formula | C21H23N3O4S |
|---|---|
| Molecular Weight | 413.14 g/mol |
| LogP | 2.36622 |
| Topological Polar Surface Area | 90.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.14093 |
| Heavy Atoms | 29 |
| Complexity | 1228.395 |
Chemical Identifiers
| CAS Number | 692279-46-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C)S(=O)(=O)NCC4CCCO4 |
Product Overview
2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide (CAS 692279-46-2), with molecular formula C21H23N3O4S and molecular weight 413.14 g/mol. IUPAC: 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide.
Chemical Property Profile of 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide
Property Insights of 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide
The XLogP value of 2.36622 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide. The TPSA of 90.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide. Following Lipinski's Rule of Five, 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide has 1 hydrogen bond donor(s) and 5 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-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide?
The CAS number of 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide is 692279-46-2.
What is the molecular formula of 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide?
The molecular formula of 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide is C21H23N3O4S.
What is the molecular weight of 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide?
The molecular weight of 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide is 413.14 g/mol.
Where can I buy 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide?
You can request a quote for 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)-N-(oxolan-2-ylmethyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.