N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide
TL;DR: N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide (CAS 442648-49-9) is a chemical compound with molecular formula C19H21N3O3S and molecular weight 371.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide
Also Known As: BAS 04375851, AB01283120-01, N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide, N-butyl-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide, N-butyl-5-(4-hydroxyphthalazin-1-yl)-2-methylbenzenesulfonamide
| Molecular Formula | C19H21N3O3S |
|---|---|
| Molecular Weight | 371.13 g/mol |
| LogP | 2.97692 |
| Topological Polar Surface Area | 91.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 371.13037 |
| Heavy Atoms | 26 |
| Complexity | 1104.4576 |
Chemical Identifiers
| CAS Number | 442648-49-9 |
|---|---|
| SMILES | CCCCNS(=O)(=O)C1=C(C=CC(=C1)C2=NNC(=O)C3=CC=CC=C32)C |
Product Overview
N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide (CAS 442648-49-9), with molecular formula C19H21N3O3S and molecular weight 371.13 g/mol. IUPAC: N-butyl-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide.
Chemical Property Profile of N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide
Property Insights of N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide
The XLogP value of 2.97692 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide. The TPSA of 91.92 Ų falls within the moderate polarity range, balancing permeability and solubility for N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide. Following Lipinski's Rule of Five, N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide has 2 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 N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide?
The CAS number of N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide is 442648-49-9.
What is the molecular formula of N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide?
The molecular formula of N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide is C19H21N3O3S.
What is the molecular weight of N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide?
The molecular weight of N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide is 371.13 g/mol.
Where can I buy N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide?
You can request a quote for N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.