N-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide

C18H12F2N4OS — CID 5189629

IUPACN-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide
SMILESO=C(Cn1c(-c2cscn2)nc2ccccc21)Nc1cc(F)ccc1F
InChIInChI=1S/C18H12F2N4OS/c19-11-5-6-12(20)14(7-11)22-17(25)8-24-16-4-2-1-3-13(16)23-18(24)15-9-26-10-21-15/h1-7,9-10H,8H2,(H,22,25)
InChIKeyZMGUBMPJKBUOPT-UHFFFAOYSA-N
MW370.38 g/mol
LogP4.08
Rot. Bonds4

About N-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide

N-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide (PubChem CID 5189629) has the molecular formula C18H12F2N4OS and a molecular weight of 370.38 g/mol. Its IUPAC name is N-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide
PubChem CID5189629
Molecular FormulaC18H12F2N4OS
Molecular Weight370.38 g/mol
Exact Mass370.07
IUPAC NameN-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide
SMILESO=C(Cn1c(-c2cscn2)nc2ccccc21)Nc1cc(F)ccc1F
InChIInChI=1S/C18H12F2N4OS/c19-11-5-6-12(20)14(7-11)22-17(25)8-24-16-4-2-1-3-13(16)23-18(24)15-9-26-10-21-15/h1-7,9-10H,8H2,(H,22,25)
InChIKeyZMGUBMPJKBUOPT-UHFFFAOYSA-N
XLogP4.08
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.38
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide?
The IUPAC name of N-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide (CID 5189629) is N-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide is O=C(Cn1c(-c2cscn2)nc2ccccc21)Nc1cc(F)ccc1F.
What is the InChIKey of N-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide?
The InChIKey is ZMGUBMPJKBUOPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F2N4OS/c19-11-5-6-12(20)14(7-11)22-17(25)8-24-16-4-2-1-3-13(16)23-18(24)15-9-26-10-21-15/h1-7,9-10H,8H2,(H,22,25).
What are the key properties of N-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide?
N-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide has a molecular weight of 370.38 g/mol, XLogP of 4.08, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-difluorophenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 5189629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).