2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole

C15H13N3S — CID 23393253

IUPAC2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole
SMILESCc1cccc(-c2csc(-c3cccc(C)n3)n2)n1
InChIInChI=1S/C15H13N3S/c1-10-5-3-7-12(16-10)14-9-19-15(18-14)13-8-4-6-11(2)17-13/h3-9H,1-2H3
InChIKeyFGRVDNHALKCHOI-UHFFFAOYSA-N
MW267.36 g/mol
LogP3.88
Rot. Bonds2

About 2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole

2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole (PubChem CID 23393253) has the molecular formula C15H13N3S and a molecular weight of 267.36 g/mol. Its IUPAC name is 2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole.

Molecular Properties

Compound Name2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole
PubChem CID23393253
Molecular FormulaC15H13N3S
Molecular Weight267.36 g/mol
Exact Mass267.08
IUPAC Name2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole
SMILESCc1cccc(-c2csc(-c3cccc(C)n3)n2)n1
InChIInChI=1S/C15H13N3S/c1-10-5-3-7-12(16-10)14-9-19-15(18-14)13-8-4-6-11(2)17-13/h3-9H,1-2H3
InChIKeyFGRVDNHALKCHOI-UHFFFAOYSA-N
XLogP3.88
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.36
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole?
The IUPAC name of 2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole (CID 23393253) is 2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole.
What is the SMILES notation for 2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole?
The canonical SMILES for 2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole is Cc1cccc(-c2csc(-c3cccc(C)n3)n2)n1.
What is the InChIKey of 2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole?
The InChIKey is FGRVDNHALKCHOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3S/c1-10-5-3-7-12(16-10)14-9-19-15(18-14)13-8-4-6-11(2)17-13/h3-9H,1-2H3.
What are the key properties of 2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole?
2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole has a molecular weight of 267.36 g/mol, XLogP of 3.88, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(6-methyl-2-pyridinyl)-1,3-thiazole is sourced from PubChem (CID 23393253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).