N-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide

C16H15N3O3S2 — CID 46280127

IUPACN-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide
SMILESCCc1cccc(NS(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)s2)c1
InChIInChI=1S/C16H15N3O3S2/c1-2-11-4-3-5-12(10-11)19-24(21,22)16-9-7-14(23-16)13-6-8-15(20)18-17-13/h3-10,19H,2H2,1H3,(H,18,20)
InChIKeyBNPAJFLOSCFTSV-UHFFFAOYSA-N
MW361.45 g/mol
LogP2.86
Rot. Bonds5

About N-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide

N-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide (PubChem CID 46280127) has the molecular formula C16H15N3O3S2 and a molecular weight of 361.45 g/mol. Its IUPAC name is N-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide
PubChem CID46280127
Molecular FormulaC16H15N3O3S2
Molecular Weight361.45 g/mol
Exact Mass361.06
IUPAC NameN-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide
SMILESCCc1cccc(NS(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)s2)c1
InChIInChI=1S/C16H15N3O3S2/c1-2-11-4-3-5-12(10-11)19-24(21,22)16-9-7-14(23-16)13-6-8-15(20)18-17-13/h3-10,19H,2H2,1H3,(H,18,20)
InChIKeyBNPAJFLOSCFTSV-UHFFFAOYSA-N
XLogP2.86
TPSA91.92 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-acetylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide
CID 20923047
N-(3-chloro-4-methoxyphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide
CID 20923062
N-(2-ethylphenyl)-N-methyl-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide
CID 20939813
N-phenyl-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiophene-2-sulfonamide
CID 53083788
6-amino-N-(3-ethylphenyl)pyridine-3-sulfonamide
CID 62144898
N-(3-ethylphenyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 32736896
2-chloro-N-(3-ethylphenyl)pyridine-3-sulfonamide
CID 24621325
5-(4,5-dimethyl-1H-pyrazol-3-yl)-N-(3-fluorophenyl)thiophene-2-sulfonamide
CID 20947535
N-(4-ethylphenyl)-2-methoxy-5-(6-oxo-1H-pyridazin-3-yl)benzenesulfonamide
CID 53054071
N-(3-ethylphenyl)pyridine-2-sulfonamide
CID 67565790
N-(3-ethylphenyl)-2-oxobenzimidazole-5-sulfonamide
CID 164745289
N-[2-[[(2S)-butan-2-yl]-(thiophen-2-ylmethyl)amino]ethyl]-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide
CID 92692985

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide?
The IUPAC name of N-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide (CID 46280127) is N-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide is CCc1cccc(NS(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)s2)c1.
What is the InChIKey of N-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide?
The InChIKey is BNPAJFLOSCFTSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3S2/c1-2-11-4-3-5-12(10-11)19-24(21,22)16-9-7-14(23-16)13-6-8-15(20)18-17-13/h3-10,19H,2H2,1H3,(H,18,20).
What are the key properties of N-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide?
N-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide has a molecular weight of 361.45 g/mol, XLogP of 2.86, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylphenyl)-5-(6-oxo-1H-pyridazin-3-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 46280127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).