N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide

C15H13N3O3S2 — CID 7553601

IUPACN-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide
SMILESCOc1ccc(-c2cccc(NS(=O)(=O)c3cccs3)c2)nn1
InChIInChI=1S/C15H13N3O3S2/c1-21-14-8-7-13(16-17-14)11-4-2-5-12(10-11)18-23(19,20)15-6-3-9-22-15/h2-10,18H,1H3
InChIKeyMYDNXBBLTYCDQX-UHFFFAOYSA-N
MW347.42 g/mol
LogP3.01
Rot. Bonds5

About N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide

N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide (PubChem CID 7553601) has the molecular formula C15H13N3O3S2 and a molecular weight of 347.42 g/mol. Its IUPAC name is N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide
PubChem CID7553601
Molecular FormulaC15H13N3O3S2
Molecular Weight347.42 g/mol
Exact Mass347.04
IUPAC NameN-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide
SMILESCOc1ccc(-c2cccc(NS(=O)(=O)c3cccs3)c2)nn1
InChIInChI=1S/C15H13N3O3S2/c1-21-14-8-7-13(16-17-14)11-4-2-5-12(10-11)18-23(19,20)15-6-3-9-22-15/h2-10,18H,1H3
InChIKeyMYDNXBBLTYCDQX-UHFFFAOYSA-N
XLogP3.01
TPSA81.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide?
The IUPAC name of N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide (CID 7553601) is N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide is COc1ccc(-c2cccc(NS(=O)(=O)c3cccs3)c2)nn1.
What is the InChIKey of N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide?
The InChIKey is MYDNXBBLTYCDQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3S2/c1-21-14-8-7-13(16-17-14)11-4-2-5-12(10-11)18-23(19,20)15-6-3-9-22-15/h2-10,18H,1H3.
What are the key properties of N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide?
N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide has a molecular weight of 347.42 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 7553601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).