N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide

C19H15N3OS — CID 852128

IUPACN-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2ccc(-c3cn4ccsc4n3)cc2)c1
InChIInChI=1S/C19H15N3OS/c1-13-3-2-4-15(11-13)18(23)20-16-7-5-14(6-8-16)17-12-22-9-10-24-19(22)21-17/h2-12H,1H3,(H,20,23)
InChIKeyJZEHTKHJBBNKSW-UHFFFAOYSA-N
MW333.42 g/mol
LogP4.62
Rot. Bonds3

About N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide

N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide (PubChem CID 852128) has the molecular formula C19H15N3OS and a molecular weight of 333.42 g/mol. Its IUPAC name is N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide.

Molecular Properties

Compound NameN-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide
PubChem CID852128
Molecular FormulaC19H15N3OS
Molecular Weight333.42 g/mol
Exact Mass333.09
IUPAC NameN-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2ccc(-c3cn4ccsc4n3)cc2)c1
InChIInChI=1S/C19H15N3OS/c1-13-3-2-4-15(11-13)18(23)20-16-7-5-14(6-8-16)17-12-22-9-10-24-19(22)21-17/h2-12H,1H3,(H,20,23)
InChIKeyJZEHTKHJBBNKSW-UHFFFAOYSA-N
XLogP4.62
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.42
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2,2-dimethylpropanoylamino)-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)benzamide
CID 30535436
3-(2,5-dioxopyrrolidin-1-yl)-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)benzamide
CID 29441698
1-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-(4-methylphenyl)urea
CID 43936533
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbenzamide
CID 40570291
N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-4-methoxybenzamide
CID 3651637
2-(2,5-dimethylphenyl)-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-1,3-dioxoisoindole-5-carboxamide
CID 26175525
N-(3-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide
CID 40506197
N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-1-oxidopyridin-1-ium-4-carboxamide
CID 37039109
N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-4-propan-2-yloxybenzamide
CID 4877617
2-hydroxy-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)benzamide
CID 37039072
N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 40722977
N-(3-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-4-iodobenzamide
CID 983313

Frequently Asked Questions

What is the IUPAC name of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide?
The IUPAC name of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide (CID 852128) is N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide.
What is the SMILES notation for N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide?
The canonical SMILES for N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide is Cc1cccc(C(=O)Nc2ccc(-c3cn4ccsc4n3)cc2)c1.
What is the InChIKey of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide?
The InChIKey is JZEHTKHJBBNKSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3OS/c1-13-3-2-4-15(11-13)18(23)20-16-7-5-14(6-8-16)17-12-22-9-10-24-19(22)21-17/h2-12H,1H3,(H,20,23).
What are the key properties of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide?
N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide has a molecular weight of 333.42 g/mol, XLogP of 4.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbenzamide is sourced from PubChem (CID 852128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).