N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide

C21H17N3O2S — CID 69002102

IUPACN-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1C=Cc1n[nH]c2ccccc12)c1ccccc1
InChIInChI=1S/C21H17N3O2S/c25-27(26,17-9-2-1-3-10-17)24-19-12-6-4-8-16(19)14-15-21-18-11-5-7-13-20(18)22-23-21/h1-15,24H,(H,22,23)
InChIKeyKMNWVPVCWDNTNR-UHFFFAOYSA-N
MW375.45 g/mol
LogP4.53
Rot. Bonds5

About N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide

N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide (PubChem CID 69002102) has the molecular formula C21H17N3O2S and a molecular weight of 375.45 g/mol. Its IUPAC name is N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide
PubChem CID69002102
Molecular FormulaC21H17N3O2S
Molecular Weight375.45 g/mol
Exact Mass375.10
IUPAC NameN-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1C=Cc1n[nH]c2ccccc12)c1ccccc1
InChIInChI=1S/C21H17N3O2S/c25-27(26,17-9-2-1-3-10-17)24-19-12-6-4-8-16(19)14-15-21-18-11-5-7-13-20(18)22-23-21/h1-15,24H,(H,22,23)
InChIKeyKMNWVPVCWDNTNR-UHFFFAOYSA-N
XLogP4.53
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 ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]cyclobutanecarboxamide
CID 68999694
N-[2-[(E)-2-pyridin-4-ylethenyl]phenyl]benzenesulfonamide
CID 139895054
2-[2-(1H-indazol-3-yl)ethenyl]-N-phenylbenzamide
CID 68996590
4-formyl-N-[2-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]benzamide
CID 86628199
3-[2-(benzenesulfonamido)phenyl]prop-2-enoic acid
CID 70280220
N-[2-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-5-methylthiophene-2-carboxamide
CID 68999169
2-[2-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]isoindole-1,3-dione
CID 69004495
N-[5-(benzenesulfonamido)naphthalen-1-yl]benzenesulfonamide
CID 3389796
6-(benzenesulfonyl)-3-[(E)-2-phenylethenyl]-1H-indazole
CID 141056052
3,4-dichloro-1-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]pyrrole-2,5-dione
CID 69004356
N-[2-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]thieno[3,2-b]thiophene-5-carboxamide
CID 68998412
N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]thieno[3,2-b]thiophene-5-carboxamide
CID 68998416

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide?
The IUPAC name of N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide (CID 69002102) is N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide.
What is the SMILES notation for N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide?
The canonical SMILES for N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide is O=S(=O)(Nc1ccccc1C=Cc1n[nH]c2ccccc12)c1ccccc1.
What is the InChIKey of N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide?
The InChIKey is KMNWVPVCWDNTNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O2S/c25-27(26,17-9-2-1-3-10-17)24-19-12-6-4-8-16(19)14-15-21-18-11-5-7-13-20(18)22-23-21/h1-15,24H,(H,22,23).
What are the key properties of N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide?
N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide has a molecular weight of 375.45 g/mol, XLogP of 4.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(1H-indazol-3-yl)ethenyl]phenyl]benzenesulfonamide is sourced from PubChem (CID 69002102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).