N-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide

C8H8N4O2S2 — CID 68654141

IUPACN-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide
SMILESNN(c1nncs1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C8H8N4O2S2/c9-12(8-11-10-6-15-8)16(13,14)7-4-2-1-3-5-7/h1-6H,9H2
InChIKeyRVYWMNVVPFZVSH-UHFFFAOYSA-N
MW256.31 g/mol
LogP0.61
Rot. Bonds3

About N-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide

N-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide (PubChem CID 68654141) has the molecular formula C8H8N4O2S2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide.

Molecular Properties

Compound NameN-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide
PubChem CID68654141
Molecular FormulaC8H8N4O2S2
Molecular Weight256.31 g/mol
Exact Mass256.01
IUPAC NameN-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide
SMILESNN(c1nncs1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C8H8N4O2S2/c9-12(8-11-10-6-15-8)16(13,14)7-4-2-1-3-5-7/h1-6H,9H2
InChIKeyRVYWMNVVPFZVSH-UHFFFAOYSA-N
XLogP0.61
TPSA89.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide?
The IUPAC name of N-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide (CID 68654141) is N-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide.
What is the SMILES notation for N-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide?
The canonical SMILES for N-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide is NN(c1nncs1)S(=O)(=O)c1ccccc1.
What is the InChIKey of N-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide?
The InChIKey is RVYWMNVVPFZVSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O2S2/c9-12(8-11-10-6-15-8)16(13,14)7-4-2-1-3-5-7/h1-6H,9H2.
What are the key properties of N-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide?
N-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide has a molecular weight of 256.31 g/mol, XLogP of 0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3,4-thiadiazol-2-yl)benzenesulfonohydrazide is sourced from PubChem (CID 68654141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).