N-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide

C10H9N3OS2 — CID 2761299

IUPACN-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide
SMILESCSc1nc(NC(=O)c2ccccc2)ns1
InChIInChI=1S/C10H9N3OS2/c1-15-10-12-9(13-16-10)11-8(14)7-5-3-2-4-6-7/h2-6H,1H3,(H,11,13,14)
InChIKeyVERDFHOICHJZIA-UHFFFAOYSA-N
MW251.34 g/mol
LogP2.51
Rot. Bonds3

About N-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide

N-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide (PubChem CID 2761299) has the molecular formula C10H9N3OS2 and a molecular weight of 251.34 g/mol. Its IUPAC name is N-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide.

Molecular Properties

Compound NameN-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide
PubChem CID2761299
Molecular FormulaC10H9N3OS2
Molecular Weight251.34 g/mol
Exact Mass251.02
IUPAC NameN-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide
SMILESCSc1nc(NC(=O)c2ccccc2)ns1
InChIInChI=1S/C10H9N3OS2/c1-15-10-12-9(13-16-10)11-8(14)7-5-3-2-4-6-7/h2-6H,1H3,(H,11,13,14)
InChIKeyVERDFHOICHJZIA-UHFFFAOYSA-N
XLogP2.51
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.34
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide 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

4-fluoro-N-(5-phenyl-1,2,4-thiadiazol-3-yl)benzamide
CID 2241556
N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide
CID 959118
N-pyrimidin-2-ylbenzamide
CID 638481
N-(6-benzamido-[1,2]thiazolo[5,4-d][1,2]thiazol-3-yl)benzamide
CID 14289002
N-(5-amino-1,2,4-thiadiazol-3-yl)-4-methylbenzamide
CID 3783171
3-methoxy-N-(5-phenyl-1,2,4-thiadiazol-3-yl)benzamide
CID 2241566
N-pyrimidin-2-ylbenzamide;silver
CID 175574792
N-(5-amino-1,2,4-thiadiazol-3-yl)-3-methylbenzamide
CID 1115754
N-(5-fluoro-1H-1,2,4-triazol-3-yl)benzamide
CID 174732439
N-(5,6-diphenyl-1,2,4-triazin-3-yl)benzamide
CID 23910989
N-(4,6-dimethoxypyrimidin-2-yl)benzamide
CID 4270193
2-methyl-N-(5-phenyl-1,2,4-thiadiazol-3-yl)benzamide
CID 2241558

Frequently Asked Questions

What is the IUPAC name of N-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide?
The IUPAC name of N-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide (CID 2761299) is N-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide.
What is the SMILES notation for N-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide?
The canonical SMILES for N-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide is CSc1nc(NC(=O)c2ccccc2)ns1.
What is the InChIKey of N-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide?
The InChIKey is VERDFHOICHJZIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3OS2/c1-15-10-12-9(13-16-10)11-8(14)7-5-3-2-4-6-7/h2-6H,1H3,(H,11,13,14).
What are the key properties of N-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide?
N-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide has a molecular weight of 251.34 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methylsulfanyl-1,2,4-thiadiazol-3-yl)benzamide is sourced from PubChem (CID 2761299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).