6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide

C16H15N3O3S2 — CID 67283461

IUPAC6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide
SMILESCOc1cc(S(=O)(=O)Nc2cc(-c3cccs3)ccc2C)cnn1
InChIInChI=1S/C16H15N3O3S2/c1-11-5-6-12(15-4-3-7-23-15)8-14(11)19-24(20,21)13-9-16(22-2)18-17-10-13/h3-10,19H,1-2H3
InChIKeyHHUDZGWNWDAEHJ-UHFFFAOYSA-N
MW361.45 g/mol
LogP3.32
Rot. Bonds5

About 6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide

6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide (PubChem CID 67283461) has the molecular formula C16H15N3O3S2 and a molecular weight of 361.45 g/mol. Its IUPAC name is 6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide.

Molecular Properties

Compound Name6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide
PubChem CID67283461
Molecular FormulaC16H15N3O3S2
Molecular Weight361.45 g/mol
Exact Mass361.06
IUPAC Name6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide
SMILESCOc1cc(S(=O)(=O)Nc2cc(-c3cccs3)ccc2C)cnn1
InChIInChI=1S/C16H15N3O3S2/c1-11-5-6-12(15-4-3-7-23-15)8-14(11)19-24(20,21)13-9-16(22-2)18-17-10-13/h3-10,19H,1-2H3
InChIKeyHHUDZGWNWDAEHJ-UHFFFAOYSA-N
XLogP3.32
TPSA81.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(2-methyl-5-thiophen-2-ylphenyl)hydrazine
CID 54385611
5-methyl-N-[2-methyl-5-(5-methylthiophen-3-yl)phenyl]thiophene-3-sulfonamide
CID 67283189
N-[2-methyl-5-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide
CID 40998603
N-(5-bromo-2-methylphenyl)thiophene-2-sulfonamide
CID 3864055
methyl 3-thiophen-2-ylbenzenesulfonate
CID 174847423
4-methyl-N-[2-methyl-5-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]benzenesulfonamide
CID 16806807
N-(5-methoxy-2-methylphenyl)-4-methylbenzenesulfonamide
CID 5146130
4-methoxy-N-(5-methoxy-2-methylphenyl)benzenesulfonamide
CID 4564561
N-(2-methoxy-3,5-dimethylphenyl)thiophene-2-sulfonamide
CID 110777538
4-iodo-N-[2-methyl-5-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]benzenesulfonamide
CID 40998612
2-(3-methylsulfonylphenyl)thiophene
CID 141164326
N-fluoro-4-thiophen-2-ylbenzenesulfonamide
CID 87730443

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide?
The IUPAC name of 6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide (CID 67283461) is 6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide.
What is the SMILES notation for 6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide?
The canonical SMILES for 6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide is COc1cc(S(=O)(=O)Nc2cc(-c3cccs3)ccc2C)cnn1.
What is the InChIKey of 6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide?
The InChIKey is HHUDZGWNWDAEHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3S2/c1-11-5-6-12(15-4-3-7-23-15)8-14(11)19-24(20,21)13-9-16(22-2)18-17-10-13/h3-10,19H,1-2H3.
What are the key properties of 6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide?
6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide has a molecular weight of 361.45 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(2-methyl-5-thiophen-2-ylphenyl)pyridazine-4-sulfonamide is sourced from PubChem (CID 67283461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).