2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide

C14H11Cl2N3O3S — CID 2242342

IUPAC2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide
SMILESCOc1cc(Cl)c(S(=O)(=O)Nc2ccc3cn[nH]c3c2)cc1Cl
InChIInChI=1S/C14H11Cl2N3O3S/c1-22-13-5-11(16)14(6-10(13)15)23(20,21)19-9-3-2-8-7-17-18-12(8)4-9/h2-7,19H,1H3,(H,17,18)
InChIKeyOSBNPTIYJHQZFK-UHFFFAOYSA-N
MW372.23 g/mol
LogP3.68
Rot. Bonds4

About 2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide

2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide (PubChem CID 2242342) has the molecular formula C14H11Cl2N3O3S and a molecular weight of 372.23 g/mol. Its IUPAC name is 2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide.

Molecular Properties

Compound Name2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide
PubChem CID2242342
Molecular FormulaC14H11Cl2N3O3S
Molecular Weight372.23 g/mol
Exact Mass370.99
IUPAC Name2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide
SMILESCOc1cc(Cl)c(S(=O)(=O)Nc2ccc3cn[nH]c3c2)cc1Cl
InChIInChI=1S/C14H11Cl2N3O3S/c1-22-13-5-11(16)14(6-10(13)15)23(20,21)19-9-3-2-8-7-17-18-12(8)4-9/h2-7,19H,1H3,(H,17,18)
InChIKeyOSBNPTIYJHQZFK-UHFFFAOYSA-N
XLogP3.68
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.23
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-indazol-6-yl)-2-methoxy-4,5-dimethylbenzenesulfonamide
CID 110731214
2,5-dichloro-4-methoxy-N-(4-methoxyphenyl)benzenesulfonamide
CID 138042252
N-(1H-indazol-6-yl)-2-methoxy-4,6-dimethylbenzenesulfonamide
CID 110759567
N-(1H-indazol-6-yl)-4-methoxy-3-propan-2-ylbenzenesulfonamide
CID 110757572
N-(1H-indazol-6-yl)-5-methyl-1H-pyrazole-4-sulfonamide
CID 61276176
4-chloro-3-(1H-indazol-6-ylsulfamoyl)benzoate
CID 7041976
N-(1H-indazol-6-yl)-2,4-dimethylbenzenesulfonamide
CID 2078539
5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide
CID 2444866
N-(1H-indazol-6-yl)sulfamoyl chloride
CID 84760699
N-(4-acetylphenyl)-2,5-dichloro-4-methoxybenzenesulfonamide
CID 138998155
2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide
CID 2445035
N-(1H-indazol-6-yl)-4-methoxy-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 100657277

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide?
The IUPAC name of 2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide (CID 2242342) is 2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide.
What is the SMILES notation for 2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide?
The canonical SMILES for 2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide is COc1cc(Cl)c(S(=O)(=O)Nc2ccc3cn[nH]c3c2)cc1Cl.
What is the InChIKey of 2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide?
The InChIKey is OSBNPTIYJHQZFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2N3O3S/c1-22-13-5-11(16)14(6-10(13)15)23(20,21)19-9-3-2-8-7-17-18-12(8)4-9/h2-7,19H,1H3,(H,17,18).
What are the key properties of 2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide?
2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide has a molecular weight of 372.23 g/mol, XLogP of 3.68, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide is sourced from PubChem (CID 2242342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).