2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide

C14H11N9O2S — CID 122687798

IUPAC2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide
SMILESNS(=O)(=O)c1cccc(-c2ccc(-c3nn[nH]n3)cc2)c1-c1nn[nH]n1
InChIInChI=1S/C14H11N9O2S/c15-26(24,25)11-3-1-2-10(12(11)14-18-22-23-19-14)8-4-6-9(7-5-8)13-16-20-21-17-13/h1-7H,(H2,15,24,25)(H,16,17,20,21)(H,18,19,22,23)
InChIKeyLHEFWGXHCXOHIO-UHFFFAOYSA-N
MW369.37 g/mol
LogP0.36
Rot. Bonds4

About 2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide

2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide (PubChem CID 122687798) has the molecular formula C14H11N9O2S and a molecular weight of 369.37 g/mol. Its IUPAC name is 2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide.

Molecular Properties

Compound Name2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide
PubChem CID122687798
Molecular FormulaC14H11N9O2S
Molecular Weight369.37 g/mol
Exact Mass369.08
IUPAC Name2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide
SMILESNS(=O)(=O)c1cccc(-c2ccc(-c3nn[nH]n3)cc2)c1-c1nn[nH]n1
InChIInChI=1S/C14H11N9O2S/c15-26(24,25)11-3-1-2-10(12(11)14-18-22-23-19-14)8-4-6-9(7-5-8)13-16-20-21-17-13/h1-7H,(H2,15,24,25)(H,16,17,20,21)(H,18,19,22,23)
InChIKeyLHEFWGXHCXOHIO-UHFFFAOYSA-N
XLogP0.36
TPSA169.08 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.37
LogP ≤ 50.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze 2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)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

3-pyridin-4-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 171344422
3-[4-(3-aminopropyl)phenyl]-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 118266200
3-(6-methoxy-3-pyridinyl)-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 118266069
3-(1H-indazol-5-yl)-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 118266110
3-quinolin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 118266312
3-(6-aminopyrazin-2-yl)-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 118265360
3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 118266109
3-(1-aminoisoquinolin-7-yl)-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 118257012
2-[methyl-[[4-[3-sulfamoyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]acetic acid
CID 118266555
3-(4-methylphenyl)-2-(2H-tetrazol-5-yl)benzenesulfonic acid
CID 171351889
3-(1H-pyrazolo[3,4-b]pyridin-5-yl)-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 118266097
3-[4-[[2-(hydroxymethyl)pyrrolidin-1-yl]methyl]phenyl]-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 118265970

Frequently Asked Questions

What is the IUPAC name of 2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide?
The IUPAC name of 2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide (CID 122687798) is 2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide.
What is the SMILES notation for 2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide?
The canonical SMILES for 2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide is NS(=O)(=O)c1cccc(-c2ccc(-c3nn[nH]n3)cc2)c1-c1nn[nH]n1.
What is the InChIKey of 2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide?
The InChIKey is LHEFWGXHCXOHIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N9O2S/c15-26(24,25)11-3-1-2-10(12(11)14-18-22-23-19-14)8-4-6-9(7-5-8)13-16-20-21-17-13/h1-7H,(H2,15,24,25)(H,16,17,20,21)(H,18,19,22,23).
What are the key properties of 2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide?
2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide has a molecular weight of 369.37 g/mol, XLogP of 0.36, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide is sourced from PubChem (CID 122687798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).