3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide

C19H15N3O2S — CID 53476530

IUPAC3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide
SMILESNS(=O)(=O)c1cccc(-c2n[nH]c3ccc(-c4ccccc4)cc23)c1
InChIInChI=1S/C19H15N3O2S/c20-25(23,24)16-8-4-7-15(11-16)19-17-12-14(9-10-18(17)21-22-19)13-5-2-1-3-6-13/h1-12H,(H,21,22)(H2,20,23,24)
InChIKeyISGSGQVHSWJQHR-UHFFFAOYSA-N
MW349.42 g/mol
LogP3.54
Rot. Bonds3

About 3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide

3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide (PubChem CID 53476530) has the molecular formula C19H15N3O2S and a molecular weight of 349.42 g/mol. Its IUPAC name is 3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide
PubChem CID53476530
Molecular FormulaC19H15N3O2S
Molecular Weight349.42 g/mol
Exact Mass349.09
IUPAC Name3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide
SMILESNS(=O)(=O)c1cccc(-c2n[nH]c3ccc(-c4ccccc4)cc23)c1
InChIInChI=1S/C19H15N3O2S/c20-25(23,24)16-8-4-7-15(11-16)19-17-12-14(9-10-18(17)21-22-19)13-5-2-1-3-6-13/h1-12H,(H,21,22)(H2,20,23,24)
InChIKeyISGSGQVHSWJQHR-UHFFFAOYSA-N
XLogP3.54
TPSA88.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.42
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide?
The IUPAC name of 3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide (CID 53476530) is 3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide.
What is the SMILES notation for 3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide?
The canonical SMILES for 3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide is NS(=O)(=O)c1cccc(-c2n[nH]c3ccc(-c4ccccc4)cc23)c1.
What is the InChIKey of 3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide?
The InChIKey is ISGSGQVHSWJQHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O2S/c20-25(23,24)16-8-4-7-15(11-16)19-17-12-14(9-10-18(17)21-22-19)13-5-2-1-3-6-13/h1-12H,(H,21,22)(H2,20,23,24).
What are the key properties of 3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide?
3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide has a molecular weight of 349.42 g/mol, XLogP of 3.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-phenyl-1H-indazol-3-yl)benzenesulfonamide is sourced from PubChem (CID 53476530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).