2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide

C21H17N3O2S — CID 67042615

IUPAC2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide
SMILESO=S(=O)(C=Cc1ccccc1)Nc1ccc2[nH]nc(-c3ccccc3)c2c1
InChIInChI=1S/C21H17N3O2S/c25-27(26,14-13-16-7-3-1-4-8-16)24-18-11-12-20-19(15-18)21(23-22-20)17-9-5-2-6-10-17/h1-15,24H,(H,22,23)
InChIKeySUYSRWIIPQUIEX-UHFFFAOYSA-N
MW375.45 g/mol
LogP4.64
Rot. Bonds5

About 2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide

2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide (PubChem CID 67042615) has the molecular formula C21H17N3O2S and a molecular weight of 375.45 g/mol. Its IUPAC name is 2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide.

Molecular Properties

Compound Name2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide
PubChem CID67042615
Molecular FormulaC21H17N3O2S
Molecular Weight375.45 g/mol
Exact Mass375.10
IUPAC Name2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide
SMILESO=S(=O)(C=Cc1ccccc1)Nc1ccc2[nH]nc(-c3ccccc3)c2c1
InChIInChI=1S/C21H17N3O2S/c25-27(26,14-13-16-7-3-1-4-8-16)24-18-11-12-20-19(15-18)21(23-22-20)17-9-5-2-6-10-17/h1-15,24H,(H,22,23)
InChIKeySUYSRWIIPQUIEX-UHFFFAOYSA-N
XLogP4.64
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.45
LogP ≤ 54.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide?
The IUPAC name of 2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide (CID 67042615) is 2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide.
What is the SMILES notation for 2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide?
The canonical SMILES for 2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide is O=S(=O)(C=Cc1ccccc1)Nc1ccc2[nH]nc(-c3ccccc3)c2c1.
What is the InChIKey of 2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide?
The InChIKey is SUYSRWIIPQUIEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O2S/c25-27(26,14-13-16-7-3-1-4-8-16)24-18-11-12-20-19(15-18)21(23-22-20)17-9-5-2-6-10-17/h1-15,24H,(H,22,23).
What are the key properties of 2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide?
2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide has a molecular weight of 375.45 g/mol, XLogP of 4.64, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(3-phenyl-1H-indazol-5-yl)ethenesulfonamide is sourced from PubChem (CID 67042615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).