2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole

C18H19N5S — CID 58540658

IUPAC2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole
SMILESCCCc1cc(-c2cnn(C)c2)c2n[nH]c(Cc3nccs3)c2c1
InChIInChI=1S/C18H19N5S/c1-3-4-12-7-14(13-10-20-23(2)11-13)18-15(8-12)16(21-22-18)9-17-19-5-6-24-17/h5-8,10-11H,3-4,9H2,1-2H3,(H,21,22)
InChIKeyLFYVTMYNIHAVSX-UHFFFAOYSA-N
MW337.45 g/mol
LogP3.96
Rot. Bonds5

About 2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole

2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole (PubChem CID 58540658) has the molecular formula C18H19N5S and a molecular weight of 337.45 g/mol. Its IUPAC name is 2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole.

Molecular Properties

Compound Name2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole
PubChem CID58540658
Molecular FormulaC18H19N5S
Molecular Weight337.45 g/mol
Exact Mass337.14
IUPAC Name2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole
SMILESCCCc1cc(-c2cnn(C)c2)c2n[nH]c(Cc3nccs3)c2c1
InChIInChI=1S/C18H19N5S/c1-3-4-12-7-14(13-10-20-23(2)11-13)18-15(8-12)16(21-22-18)9-17-19-5-6-24-17/h5-8,10-11H,3-4,9H2,1-2H3,(H,21,22)
InChIKeyLFYVTMYNIHAVSX-UHFFFAOYSA-N
XLogP3.96
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.45
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole 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

Phenyl-5-(1H-pyrazol-3-YL)-1,3-thiazole
CID 2763788
5-(5-{[(2S)-2-amino-3-(1H-indol-3-yl)propyl]sulfanyl}pyridin-3-yl)-3-methyl-1H-indazole
CID 23647014
2-{3-[5-(piperidin-1-ylmethyl)-1H-indol-2-yl]-1H-indazol-6-yl}-1,3-thiazole
CID 135559063
5-[3-(Quinolin-3-Yl)-2h-Indazol-5-Yl]-1,3-Thiazol-2-Amine
CID 87057584
4-(1H-indazol-5-yl)-2-methylthiazole
CID 25167076
4-(1H-indazol-5-yl)thiazol-2-amine
CID 25167079
US11608337, Example 40
CID 132085886
(2E)-3-(2H-indazol-6-ylamino)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile
CID 1934348
4-methyl-2-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]-1,3-thiazole
CID 44523476
4-[4-(1H-pyrazol-4-yl)quinolin-6-yl]-2-(1,3-thiazol-2-yl)but-3-yn-2-ol
CID 162649124
N-methyl-5-[3-(1H-pyrazol-4-yl)-1H-indol-5-yl]-1,3,4-thiadiazol-2-amine
CID 68328742
N-methyl-5-[3-(1H-pyrazol-5-yl)-1H-indol-5-yl]-1,3,4-thiadiazol-2-amine
CID 136419470

Frequently Asked Questions

What is the IUPAC name of 2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole?
The IUPAC name of 2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole (CID 58540658) is 2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole.
What is the SMILES notation for 2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole?
The canonical SMILES for 2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole is CCCc1cc(-c2cnn(C)c2)c2n[nH]c(Cc3nccs3)c2c1.
What is the InChIKey of 2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole?
The InChIKey is LFYVTMYNIHAVSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5S/c1-3-4-12-7-14(13-10-20-23(2)11-13)18-15(8-12)16(21-22-18)9-17-19-5-6-24-17/h5-8,10-11H,3-4,9H2,1-2H3,(H,21,22).
What are the key properties of 2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole?
2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole has a molecular weight of 337.45 g/mol, XLogP of 3.96, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[7-(1-methylpyrazol-4-yl)-5-propyl-2H-indazol-3-yl]methyl]-1,3-thiazole is sourced from PubChem (CID 58540658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).