2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide

C15H10N4O2S3 — CID 47066432

IUPAC2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide
SMILESO=C(Cc1csc(-c2ccco2)n1)Nc1nnc(-c2ccsc2)s1
InChIInChI=1S/C15H10N4O2S3/c20-12(6-10-8-23-14(16-10)11-2-1-4-21-11)17-15-19-18-13(24-15)9-3-5-22-7-9/h1-5,7-8H,6H2,(H,17,19,20)
InChIKeyGMUKSFOZXNIYGW-UHFFFAOYSA-N
MW374.47 g/mol
LogP4.16
Rot. Bonds5

About 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide

2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide (PubChem CID 47066432) has the molecular formula C15H10N4O2S3 and a molecular weight of 374.47 g/mol. Its IUPAC name is 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide
PubChem CID47066432
Molecular FormulaC15H10N4O2S3
Molecular Weight374.47 g/mol
Exact Mass374.00
IUPAC Name2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide
SMILESO=C(Cc1csc(-c2ccco2)n1)Nc1nnc(-c2ccsc2)s1
InChIInChI=1S/C15H10N4O2S3/c20-12(6-10-8-23-14(16-10)11-2-1-4-21-11)17-15-19-18-13(24-15)9-3-5-22-7-9/h1-5,7-8H,6H2,(H,17,19,20)
InChIKeyGMUKSFOZXNIYGW-UHFFFAOYSA-N
XLogP4.16
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.47
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide?
The IUPAC name of 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide (CID 47066432) is 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide.
What is the SMILES notation for 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide?
The canonical SMILES for 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide is O=C(Cc1csc(-c2ccco2)n1)Nc1nnc(-c2ccsc2)s1.
What is the InChIKey of 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide?
The InChIKey is GMUKSFOZXNIYGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4O2S3/c20-12(6-10-8-23-14(16-10)11-2-1-4-21-11)17-15-19-18-13(24-15)9-3-5-22-7-9/h1-5,7-8H,6H2,(H,17,19,20).
What are the key properties of 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide?
2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide has a molecular weight of 374.47 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)acetamide is sourced from PubChem (CID 47066432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).