2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole

C12H9Cl2N3S2 — CID 71880803

IUPAC2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole
SMILESCc1csc(SCc2cn3cc(Cl)cc(Cl)c3n2)n1
InChIInChI=1S/C12H9Cl2N3S2/c1-7-5-18-12(15-7)19-6-9-4-17-3-8(13)2-10(14)11(17)16-9/h2-5H,6H2,1H3
InChIKeyBRIRPWHUAMRHJO-UHFFFAOYSA-N
MW330.27 g/mol
LogP4.70
Rot. Bonds3

About 2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole

2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole (PubChem CID 71880803) has the molecular formula C12H9Cl2N3S2 and a molecular weight of 330.27 g/mol. Its IUPAC name is 2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole.

Molecular Properties

Compound Name2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole
PubChem CID71880803
Molecular FormulaC12H9Cl2N3S2
Molecular Weight330.27 g/mol
Exact Mass328.96
IUPAC Name2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole
SMILESCc1csc(SCc2cn3cc(Cl)cc(Cl)c3n2)n1
InChIInChI=1S/C12H9Cl2N3S2/c1-7-5-18-12(15-7)19-6-9-4-17-3-8(13)2-10(14)11(17)16-9/h2-5H,6H2,1H3
InChIKeyBRIRPWHUAMRHJO-UHFFFAOYSA-N
XLogP4.70
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.27
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine
CID 52830020
6,8-dichloro-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]imidazo[1,2-a]pyridine
CID 60612411
2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,3-benzoxazole
CID 52830012
(2R)-4-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methyl]-2-(4-methyl-1,3-thiazol-2-yl)morpholine
CID 100667020
1-(4-chlorophenyl)-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethanol
CID 110884759
2-[(4-chloro-2-fluorophenyl)methylsulfanyl]-4-methyl-1,3-thiazole
CID 134065458
5-[2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-oxazole
CID 91644735
2-chloro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1,3-thiazole
CID 79764244
N-(3,5-dichlorophenyl)-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]acetamide
CID 2532912
4-[2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methyl]-1,3-thiazol-4-yl]benzene-1,3-diol
CID 51134058
[2-chloro-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanamine
CID 62944053
1-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-2-one
CID 43414039

Frequently Asked Questions

What is the IUPAC name of 2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole?
The IUPAC name of 2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole (CID 71880803) is 2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole.
What is the SMILES notation for 2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole?
The canonical SMILES for 2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole is Cc1csc(SCc2cn3cc(Cl)cc(Cl)c3n2)n1.
What is the InChIKey of 2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole?
The InChIKey is BRIRPWHUAMRHJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2N3S2/c1-7-5-18-12(15-7)19-6-9-4-17-3-8(13)2-10(14)11(17)16-9/h2-5H,6H2,1H3.
What are the key properties of 2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole?
2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole has a molecular weight of 330.27 g/mol, XLogP of 4.70, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-methyl-1,3-thiazole is sourced from PubChem (CID 71880803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).