2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide

C8H9N5OS3 — CID 2202545

IUPAC2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SMILESCc1cnc(NC(=O)CSc2nnc(N)s2)s1
InChIInChI=1S/C8H9N5OS3/c1-4-2-10-7(16-4)11-5(14)3-15-8-13-12-6(9)17-8/h2H,3H2,1H3,(H2,9,12)(H,10,11,14)
InChIKeyQKVAWOQHXLDOQX-UHFFFAOYSA-N
MW287.40 g/mol
LogP1.62
Rot. Bonds4

About 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide

2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide (PubChem CID 2202545) has the molecular formula C8H9N5OS3 and a molecular weight of 287.40 g/mol. Its IUPAC name is 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide
PubChem CID2202545
Molecular FormulaC8H9N5OS3
Molecular Weight287.40 g/mol
Exact Mass287.00
IUPAC Name2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SMILESCc1cnc(NC(=O)CSc2nnc(N)s2)s1
InChIInChI=1S/C8H9N5OS3/c1-4-2-10-7(16-4)11-5(14)3-15-8-13-12-6(9)17-8/h2H,3H2,1H3,(H2,9,12)(H,10,11,14)
InChIKeyQKVAWOQHXLDOQX-UHFFFAOYSA-N
XLogP1.62
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.40
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide 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

CID 1887129
CID 1887129
CID 971169
CID 971169
CID 3892980
CID 3892980
CID 1796567
CID 1796567
CID 2994444
CID 2994444
CID 4135527
CID 4135527
CID 31515523
CID 31515523
CID 2198068
CID 2198068
CID 2952549
CID 2952549
CID 4181957
CID 4181957
CID 4386981
CID 4386981
CID 5301294
CID 5301294

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide (CID 2202545) is 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide is Cc1cnc(NC(=O)CSc2nnc(N)s2)s1.
What is the InChIKey of 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is QKVAWOQHXLDOQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5OS3/c1-4-2-10-7(16-4)11-5(14)3-15-8-13-12-6(9)17-8/h2H,3H2,1H3,(H2,9,12)(H,10,11,14).
What are the key properties of 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 287.40 g/mol, XLogP of 1.62, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 2202545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).