2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole

C14H10N4S — CID 137228711

IUPAC2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole
SMILESc1ccc2c(-c3nccs3)c(-c3ccn[nH]3)[nH]c2c1
InChIInChI=1S/C14H10N4S/c1-2-4-10-9(3-1)12(14-15-7-8-19-14)13(17-10)11-5-6-16-18-11/h1-8,17H,(H,16,18)
InChIKeyGTMHESSGDYRXOF-UHFFFAOYSA-N
MW266.33 g/mol
LogP3.68
Rot. Bonds2

About 2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole

2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole (PubChem CID 137228711) has the molecular formula C14H10N4S and a molecular weight of 266.33 g/mol. Its IUPAC name is 2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole.

Molecular Properties

Compound Name2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole
PubChem CID137228711
Molecular FormulaC14H10N4S
Molecular Weight266.33 g/mol
Exact Mass266.06
IUPAC Name2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole
SMILESc1ccc2c(-c3nccs3)c(-c3ccn[nH]3)[nH]c2c1
InChIInChI=1S/C14H10N4S/c1-2-4-10-9(3-1)12(14-15-7-8-19-14)13(17-10)11-5-6-16-18-11/h1-8,17H,(H,16,18)
InChIKeyGTMHESSGDYRXOF-UHFFFAOYSA-N
XLogP3.68
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-pentyl-1H-indol-3-yl)-1,3-thiazole
CID 12066004
2-[2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-1H-imidazol-5-yl]-1,3-thiazole
CID 141214750
2-(2H-isoindol-1-yl)-1,3-thiazole
CID 142631117
3-(1,3-thiazol-2-yl)-1H-quinazoline-2,4-dione
CID 91621526
2-(3,10-diphenylanthracen-9-yl)-1,3-thiazole
CID 134471955
1-(1H-pyrazol-5-yl)-5H-pyridazino[4,5-b]indole
CID 140617726
2-[(E)-2-[2-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-1H-indol-3-yl]ethenyl]-1,3-thiazole
CID 122628108
ethane;5-phenyl-1H-pyrazole;2-phenylpyridine;2-phenyl-1,3-thiazole;2-phenylthiophene
CID 159789083
4-[5-phenoxy-2-(1,3-thiazol-2-yl)-1H-indol-3-yl]butan-1-amine
CID 5253116
2-(1H-pyrrol-2-yl)-1,3-thiazole
CID 10582938
6-(2-methyl-1H-indol-3-yl)-1H-pyrimidin-2-one
CID 116900687
bicyclo[4.1.0]hepta-1,3,5-trien-7-one;2-(4-fluorophenyl)-1,3-thiazole
CID 174768764

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole?
The IUPAC name of 2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole (CID 137228711) is 2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole.
What is the SMILES notation for 2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole?
The canonical SMILES for 2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole is c1ccc2c(-c3nccs3)c(-c3ccn[nH]3)[nH]c2c1.
What is the InChIKey of 2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole?
The InChIKey is GTMHESSGDYRXOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4S/c1-2-4-10-9(3-1)12(14-15-7-8-19-14)13(17-10)11-5-6-16-18-11/h1-8,17H,(H,16,18).
What are the key properties of 2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole?
2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole has a molecular weight of 266.33 g/mol, XLogP of 3.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1H-pyrazol-5-yl)-1H-indol-3-yl]-1,3-thiazole is sourced from PubChem (CID 137228711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).