(Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide
TL;DR: (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide (CAS 799773-50-5) is a chemical compound with molecular formula C21H20N6O3S2 and molecular weight 468.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylideneamino]benzenesulfonamide
Also Known As: (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide, N-(5-ETHYL-1,3,4-THIADIAZOL-2-YL)-4-({[(4E)-3-METHYL-5-OXO-1-PHENYL-4,5-DIHYDRO-1H-PYRAZOL-4-YLIDENE]METHYL}AMINO)BENZENE-1-SULFONAMIDE, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methylamino]benzenesulfonamide, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]amino]benzenesulfonamide, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}benzenesulfonamide
| Molecular Formula | C21H20N6O3S2 |
|---|---|
| Molecular Weight | 468.10 g/mol |
| LogP | 3.43932 |
| Topological Polar Surface Area | 122.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 468.10382 |
| Heavy Atoms | 32 |
| Complexity | 1418.4531 |
Chemical Identifiers
| CAS Number | 799773-50-5 |
|---|---|
| SMILES | CCC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)N=CC3=C(NN(C3=O)C4=CC=CC=C4)C |
Product Overview
(Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide (CAS 799773-50-5), with molecular formula C21H20N6O3S2 and molecular weight 468.10 g/mol. IUPAC: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylideneamino]benzenesulfonamide.
Chemical Property Profile of (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide
Property Insights of (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide
The XLogP value of 3.43932 indicates that (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide. Following Lipinski's Rule of Five, (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide has 2 hydrogen bond donor(s) and 7 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 (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide?
The CAS number of (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide is 799773-50-5.
What is the molecular formula of (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide?
The molecular formula of (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide is C21H20N6O3S2.
What is the molecular weight of (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide?
The molecular weight of (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide is 468.10 g/mol.
Where can I buy (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide?
You can request a quote for (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.