6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole

C13H11N5S2 — CID 122145942

IUPAC6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole
SMILESCc1nc2sccn2c1-c1nc(-c2cnn(C)c2)cs1
InChIInChI=1S/C13H11N5S2/c1-8-11(18-3-4-19-13(18)15-8)12-16-10(7-20-12)9-5-14-17(2)6-9/h3-7H,1-2H3
InChIKeyVGBWMQUBRGWJFT-UHFFFAOYSA-N
MW301.40 g/mol
LogP3.23
Rot. Bonds2

About 6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole

6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole (PubChem CID 122145942) has the molecular formula C13H11N5S2 and a molecular weight of 301.40 g/mol. Its IUPAC name is 6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole
PubChem CID122145942
Molecular FormulaC13H11N5S2
Molecular Weight301.40 g/mol
Exact Mass301.05
IUPAC Name6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole
SMILESCc1nc2sccn2c1-c1nc(-c2cnn(C)c2)cs1
InChIInChI=1S/C13H11N5S2/c1-8-11(18-3-4-19-13(18)15-8)12-16-10(7-20-12)9-5-14-17(2)6-9/h3-7H,1-2H3
InChIKeyVGBWMQUBRGWJFT-UHFFFAOYSA-N
XLogP3.23
TPSA48.01 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.40
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole (CID 122145942) is 6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole is Cc1nc2sccn2c1-c1nc(-c2cnn(C)c2)cs1.
What is the InChIKey of 6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole?
The InChIKey is VGBWMQUBRGWJFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5S2/c1-8-11(18-3-4-19-13(18)15-8)12-16-10(7-20-12)9-5-14-17(2)6-9/h3-7H,1-2H3.
What are the key properties of 6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole?
6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole has a molecular weight of 301.40 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 122145942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).