2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone

C16H16N4O2S2 — CID 32701909

IUPAC2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone
SMILESO=C(Cc1csc(-c2ccco2)n1)N1CCN(c2nccs2)CC1
InChIInChI=1S/C16H16N4O2S2/c21-14(10-12-11-24-15(18-12)13-2-1-8-22-13)19-4-6-20(7-5-19)16-17-3-9-23-16/h1-3,8-9,11H,4-7,10H2
InChIKeyRVVYCKUIOCTDQG-UHFFFAOYSA-N
MW360.46 g/mol
LogP2.75
Rot. Bonds4

About 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone

2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone (PubChem CID 32701909) has the molecular formula C16H16N4O2S2 and a molecular weight of 360.46 g/mol. Its IUPAC name is 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone.

Molecular Properties

Compound Name2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone
PubChem CID32701909
Molecular FormulaC16H16N4O2S2
Molecular Weight360.46 g/mol
Exact Mass360.07
IUPAC Name2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone
SMILESO=C(Cc1csc(-c2ccco2)n1)N1CCN(c2nccs2)CC1
InChIInChI=1S/C16H16N4O2S2/c21-14(10-12-11-24-15(18-12)13-2-1-8-22-13)19-4-6-20(7-5-19)16-17-3-9-23-16/h1-3,8-9,11H,4-7,10H2
InChIKeyRVVYCKUIOCTDQG-UHFFFAOYSA-N
XLogP2.75
TPSA62.47 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone 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 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone?
The IUPAC name of 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone (CID 32701909) is 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone.
What is the SMILES notation for 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone?
The canonical SMILES for 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone is O=C(Cc1csc(-c2ccco2)n1)N1CCN(c2nccs2)CC1.
What is the InChIKey of 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone?
The InChIKey is RVVYCKUIOCTDQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O2S2/c21-14(10-12-11-24-15(18-12)13-2-1-8-22-13)19-4-6-20(7-5-19)16-17-3-9-23-16/h1-3,8-9,11H,4-7,10H2.
What are the key properties of 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone?
2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone has a molecular weight of 360.46 g/mol, XLogP of 2.75, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone is sourced from PubChem (CID 32701909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).