2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide

C18H13ClN4OS — CID 16661440

IUPAC2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide
SMILESO=C(Cn1cnc2ccccc21)Nc1nc(-c2cccc(Cl)c2)cs1
InChIInChI=1S/C18H13ClN4OS/c19-13-5-3-4-12(8-13)15-10-25-18(21-15)22-17(24)9-23-11-20-14-6-1-2-7-16(14)23/h1-8,10-11H,9H2,(H,21,22,24)
InChIKeyZFDYNJGIUWPLIQ-UHFFFAOYSA-N
MW368.85 g/mol
LogP4.45
Rot. Bonds4

About 2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide

2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide (PubChem CID 16661440) has the molecular formula C18H13ClN4OS and a molecular weight of 368.85 g/mol. Its IUPAC name is 2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound Name2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide
PubChem CID16661440
Molecular FormulaC18H13ClN4OS
Molecular Weight368.85 g/mol
Exact Mass368.05
IUPAC Name2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide
SMILESO=C(Cn1cnc2ccccc21)Nc1nc(-c2cccc(Cl)c2)cs1
InChIInChI=1S/C18H13ClN4OS/c19-13-5-3-4-12(8-13)15-10-25-18(21-15)22-17(24)9-23-11-20-14-6-1-2-7-16(14)23/h1-8,10-11H,9H2,(H,21,22,24)
InChIKeyZFDYNJGIUWPLIQ-UHFFFAOYSA-N
XLogP4.45
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.85
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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N-(4-naphthalen-1-yl-1,3-thiazol-2-yl)-2-(4-oxoquinazolin-3-yl)acetamide
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CID 40596964
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CID 66899593
N-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-2-(5-methyl-4-oxoimidazo[4,5-c]pyridin-3-yl)acetamide
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N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-(4-oxoquinazolin-3-yl)acetamide
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N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-(5-methyl-4-oxoimidazo[4,5-c]pyridin-3-yl)acetamide
CID 87424099
N-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
CID 26176224
2-(benzimidazol-1-yl)-N-[2-(3-chlorophenyl)propan-2-yl]acetamide
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Frequently Asked Questions

What is the IUPAC name of 2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide?
The IUPAC name of 2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide (CID 16661440) is 2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for 2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for 2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide is O=C(Cn1cnc2ccccc21)Nc1nc(-c2cccc(Cl)c2)cs1.
What is the InChIKey of 2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide?
The InChIKey is ZFDYNJGIUWPLIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13ClN4OS/c19-13-5-3-4-12(8-13)15-10-25-18(21-15)22-17(24)9-23-11-20-14-6-1-2-7-16(14)23/h1-8,10-11H,9H2,(H,21,22,24).
What are the key properties of 2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide?
2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide has a molecular weight of 368.85 g/mol, XLogP of 4.45, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzimidazol-1-yl)-N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 16661440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).