4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine

C19H19N7S — CID 155976627

IUPAC4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine
SMILESCc1ccn(-c2ccc(N3CCN(c4nccc5sccc45)CC3)nn2)n1
InChIInChI=1S/C19H19N7S/c1-14-5-8-26(23-14)18-3-2-17(21-22-18)24-9-11-25(12-10-24)19-15-6-13-27-16(15)4-7-20-19/h2-8,13H,9-12H2,1H3
InChIKeyLYHBRSWEWDOLAV-UHFFFAOYSA-N
MW377.48 g/mol
LogP2.91
Rot. Bonds3

About 4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine

4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine (PubChem CID 155976627) has the molecular formula C19H19N7S and a molecular weight of 377.48 g/mol. Its IUPAC name is 4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine.

Molecular Properties

Compound Name4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine
PubChem CID155976627
Molecular FormulaC19H19N7S
Molecular Weight377.48 g/mol
Exact Mass377.14
IUPAC Name4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine
SMILESCc1ccn(-c2ccc(N3CCN(c4nccc5sccc45)CC3)nn2)n1
InChIInChI=1S/C19H19N7S/c1-14-5-8-26(23-14)18-3-2-17(21-22-18)24-9-11-25(12-10-24)19-15-6-13-27-16(15)4-7-20-19/h2-8,13H,9-12H2,1H3
InChIKeyLYHBRSWEWDOLAV-UHFFFAOYSA-N
XLogP2.91
TPSA62.97 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.48
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Related Compounds

4-[4-[6-(3-methylpyrazol-1-yl)pyrimidin-4-yl]piperazin-1-yl]thieno[3,2-c]pyridine
CID 166601898
4-[4-(2-methyl-6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]thieno[3,2-c]pyridine
CID 155976571
4-[6-(4-thieno[3,2-c]pyridin-4-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine
CID 155976528
3-methyl-1-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]pyrrolidin-3-ol
CID 133410717
1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carbaldehyde
CID 55101087
4-[4-(5-methoxypyrimidin-2-yl)piperazin-1-yl]thieno[3,2-c]pyridine
CID 171702458
5-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]pyrazolo[1,5-a]pyrimidine
CID 155942755
2-methyl-4-[[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]methyl]-1,3-thiazole
CID 127292092
4-[4-(bromomethyl)piperidin-1-yl]thieno[3,2-c]pyridine
CID 80669496
4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]-N-thiophen-2-ylpiperazine-1-carboxamide
CID 122346068
1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide
CID 155980991
N,N-dimethyl-4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazine-1-carboxamide
CID 133291071

Frequently Asked Questions

What is the IUPAC name of 4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine?
The IUPAC name of 4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine (CID 155976627) is 4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine.
What is the SMILES notation for 4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine?
The canonical SMILES for 4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine is Cc1ccn(-c2ccc(N3CCN(c4nccc5sccc45)CC3)nn2)n1.
What is the InChIKey of 4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine?
The InChIKey is LYHBRSWEWDOLAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N7S/c1-14-5-8-26(23-14)18-3-2-17(21-22-18)24-9-11-25(12-10-24)19-15-6-13-27-16(15)4-7-20-19/h2-8,13H,9-12H2,1H3.
What are the key properties of 4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine?
4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine has a molecular weight of 377.48 g/mol, XLogP of 2.91, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]thieno[3,2-c]pyridine is sourced from PubChem (CID 155976627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).