furan-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone

C17H16N4O2S — CID 18569378

IUPACfuran-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCN(c2ccc(-c3cccs3)nn2)CC1
InChIInChI=1S/C17H16N4O2S/c22-17(14-3-1-11-23-14)21-9-7-20(8-10-21)16-6-5-13(18-19-16)15-4-2-12-24-15/h1-6,11-12H,7-10H2
InChIKeyCGIKRXAVXUVZPN-UHFFFAOYSA-N
MW340.41 g/mol
LogP2.76
Rot. Bonds3

About furan-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone

furan-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone (PubChem CID 18569378) has the molecular formula C17H16N4O2S and a molecular weight of 340.41 g/mol. Its IUPAC name is furan-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone
PubChem CID18569378
Molecular FormulaC17H16N4O2S
Molecular Weight340.41 g/mol
Exact Mass340.10
IUPAC Namefuran-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCN(c2ccc(-c3cccs3)nn2)CC1
InChIInChI=1S/C17H16N4O2S/c22-17(14-3-1-11-23-14)21-9-7-20(8-10-21)16-6-5-13(18-19-16)15-4-2-12-24-15/h1-6,11-12H,7-10H2
InChIKeyCGIKRXAVXUVZPN-UHFFFAOYSA-N
XLogP2.76
TPSA62.47 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.41
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

Furan-2-yl-[4-[5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]piperazin-1-yl]methanone
CID 6616033
N-(6-((4-((2-fluorophenyl)amino)-4-oxobutyl)thio)pyridazin-3-yl)furan-2-carboxamide
CID 42173796
1-[5-[6-[4-(Furan-2-carbonyl)piperazin-1-yl]pyrimidin-4-yl]thiophen-2-yl]ethanone
CID 172434565
4-(6-(furan-2-yl)pyridazin-3-yl)-N-(thiophen-2-yl)piperazine-1-carboxamide
CID 25817284
Furan-2-yl(4-(6-(furan-2-yl)pyridazin-3-yl)piperazin-1-yl)methanone
CID 18569362
(4-(6-(Furan-2-yl)pyridazin-3-yl)piperazin-1-yl)(thiophen-2-yl)methanone
CID 18569363
2-Phenoxy-1-(4-(6-(thiophen-2-yl)pyridazin-3-yl)piperazin-1-yl)ethanone
CID 18569382
3-(Furan-2-yl)-6-(4-(thiophen-2-ylsulfonyl)piperazin-1-yl)pyridazine
CID 25283801
3-{4-[(5-Ethylthiophen-2-yl)sulfonyl]piperazin-1-yl}-6-(furan-2-yl)pyridazine
CID 25283804
3-(Furan-2-yl)-6-(4-((5-methylthiophen-2-yl)sulfonyl)piperazin-1-yl)pyridazine
CID 25283809
N-(6-((2-morpholinoethyl)thio)pyridazin-3-yl)furan-2-carboxamide
CID 30851593
1-(6-(furan-2-yl)pyridazin-3-yl)-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide
CID 30866938

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone?
The IUPAC name of furan-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone (CID 18569378) is furan-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone.
What is the SMILES notation for furan-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone?
The canonical SMILES for furan-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone is O=C(c1ccco1)N1CCN(c2ccc(-c3cccs3)nn2)CC1.
What is the InChIKey of furan-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone?
The InChIKey is CGIKRXAVXUVZPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O2S/c22-17(14-3-1-11-23-14)21-9-7-20(8-10-21)16-6-5-13(18-19-16)15-4-2-12-24-15/h1-6,11-12H,7-10H2.
What are the key properties of furan-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone?
furan-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone has a molecular weight of 340.41 g/mol, XLogP of 2.76, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 18569378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).