N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide

C18H19N3O3S2 — CID 7524038

IUPACN-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide
SMILESCC(C)COc1ccc(-c2ccc(NS(=O)(=O)c3cccs3)cc2)nn1
InChIInChI=1S/C18H19N3O3S2/c1-13(2)12-24-17-10-9-16(19-20-17)14-5-7-15(8-6-14)21-26(22,23)18-4-3-11-25-18/h3-11,13,21H,12H2,1-2H3
InChIKeyOOYVGFQSUAIOPE-UHFFFAOYSA-N
MW389.50 g/mol
LogP4.04
Rot. Bonds7

About N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide

N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide (PubChem CID 7524038) has the molecular formula C18H19N3O3S2 and a molecular weight of 389.50 g/mol. Its IUPAC name is N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide
PubChem CID7524038
Molecular FormulaC18H19N3O3S2
Molecular Weight389.50 g/mol
Exact Mass389.09
IUPAC NameN-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide
SMILESCC(C)COc1ccc(-c2ccc(NS(=O)(=O)c3cccs3)cc2)nn1
InChIInChI=1S/C18H19N3O3S2/c1-13(2)12-24-17-10-9-16(19-20-17)14-5-7-15(8-6-14)21-26(22,23)18-4-3-11-25-18/h3-11,13,21H,12H2,1-2H3
InChIKeyOOYVGFQSUAIOPE-UHFFFAOYSA-N
XLogP4.04
TPSA81.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.50
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]pyridine-3-sulfonamide
CID 7519314
N-[3-(6-propoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide
CID 7524020
N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide
CID 7553601
N-[3-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]-4-phenylbenzenesulfonamide
CID 43985818
N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide
CID 5002728
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]thiophene-2-sulfonamide
CID 42998818
2-chloro-N-[3-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]benzenesulfonamide
CID 43985825
N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide
CID 43416696
4-methyl-N-[4-(6-propoxypyridazin-3-yl)phenyl]benzenesulfonamide
CID 8523124
N-[4-(4-ethoxyanilino)phenyl]thiophene-2-sulfonamide
CID 112987709
N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide
CID 43508090
N-[4-[(4-methylphenyl)sulfamoyl]phenyl]thiophene-2-sulfonamide
CID 1075762

Frequently Asked Questions

What is the IUPAC name of N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide?
The IUPAC name of N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide (CID 7524038) is N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide is CC(C)COc1ccc(-c2ccc(NS(=O)(=O)c3cccs3)cc2)nn1.
What is the InChIKey of N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide?
The InChIKey is OOYVGFQSUAIOPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3S2/c1-13(2)12-24-17-10-9-16(19-20-17)14-5-7-15(8-6-14)21-26(22,23)18-4-3-11-25-18/h3-11,13,21H,12H2,1-2H3.
What are the key properties of N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide?
N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide has a molecular weight of 389.50 g/mol, XLogP of 4.04, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 7524038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).