furan-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone

C18H16N6O2S — CID 133462677

IUPACfuran-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCN(c2nn3cc(-c4cccnc4)nc3s2)CC1
InChIInChI=1S/C18H16N6O2S/c25-16(15-4-2-10-26-15)22-6-8-23(9-7-22)18-21-24-12-14(20-17(24)27-18)13-3-1-5-19-11-13/h1-5,10-12H,6-9H2
InChIKeyBFJSWXYTGNXPQC-UHFFFAOYSA-N
MW380.43 g/mol
LogP2.41
Rot. Bonds3

About furan-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone

furan-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone (PubChem CID 133462677) has the molecular formula C18H16N6O2S and a molecular weight of 380.43 g/mol. Its IUPAC name is furan-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone
PubChem CID133462677
Molecular FormulaC18H16N6O2S
Molecular Weight380.43 g/mol
Exact Mass380.11
IUPAC Namefuran-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCN(c2nn3cc(-c4cccnc4)nc3s2)CC1
InChIInChI=1S/C18H16N6O2S/c25-16(15-4-2-10-26-15)22-6-8-23(9-7-22)18-21-24-12-14(20-17(24)27-18)13-3-1-5-19-11-13/h1-5,10-12H,6-9H2
InChIKeyBFJSWXYTGNXPQC-UHFFFAOYSA-N
XLogP2.41
TPSA79.77 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.43
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze furan-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone 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

ethyl 4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazine-1-carboxylate
CID 133462646
2-(4-phenylpiperazin-1-yl)-6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole
CID 133462553
3-methyl-1-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperidin-4-one
CID 133497389
[4-(furan-2-carbonyl)piperazin-1-yl]-[1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-4-yl]methanone
CID 30365181
2-[2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl]-6-pyridin-3-ylpyridazin-3-one
CID 121052354
2-[1-(2-phenylethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl]-6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole
CID 133452475
[4-[5-(tert-butylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl]-(furan-2-yl)methanone
CID 50825829
1-(furan-2-carbonyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide
CID 17481227
[4-(5,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(furan-2-yl)methanone
CID 7539700
2-[4-(6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 25468496
furan-2-yl-[4-[6-methyl-2-(pyridin-3-ylmethylamino)pyrimidin-4-yl]piperazin-1-yl]methanone
CID 112919591
[4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone
CID 47137505

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone?
The IUPAC name of furan-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone (CID 133462677) is furan-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone.
What is the SMILES notation for furan-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone?
The canonical SMILES for furan-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone is O=C(c1ccco1)N1CCN(c2nn3cc(-c4cccnc4)nc3s2)CC1.
What is the InChIKey of furan-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone?
The InChIKey is BFJSWXYTGNXPQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N6O2S/c25-16(15-4-2-10-26-15)22-6-8-23(9-7-22)18-21-24-12-14(20-17(24)27-18)13-3-1-5-19-11-13/h1-5,10-12H,6-9H2.
What are the key properties of furan-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone?
furan-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone has a molecular weight of 380.43 g/mol, XLogP of 2.41, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[4-(6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 133462677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).