2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide

C14H11ClFNOS — CID 738704

IUPAC2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide
SMILESO=C(CSc1ccc(Cl)cc1)Nc1ccc(F)cc1
InChIInChI=1S/C14H11ClFNOS/c15-10-1-7-13(8-2-10)19-9-14(18)17-12-5-3-11(16)4-6-12/h1-8H,9H2,(H,17,18)
InChIKeyURICZDJRKRXLCK-UHFFFAOYSA-N
MW295.77 g/mol
LogP4.21
Rot. Bonds4

About 2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide

2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide (PubChem CID 738704) has the molecular formula C14H11ClFNOS and a molecular weight of 295.77 g/mol. Its IUPAC name is 2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide
PubChem CID738704
Molecular FormulaC14H11ClFNOS
Molecular Weight295.77 g/mol
Exact Mass295.02
IUPAC Name2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide
SMILESO=C(CSc1ccc(Cl)cc1)Nc1ccc(F)cc1
InChIInChI=1S/C14H11ClFNOS/c15-10-1-7-13(8-2-10)19-9-14(18)17-12-5-3-11(16)4-6-12/h1-8H,9H2,(H,17,18)
InChIKeyURICZDJRKRXLCK-UHFFFAOYSA-N
XLogP4.21
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.77
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-fluorophenyl)-2-(4-methylphenyl)sulfanylacetamide
CID 2824699
N-(4-fluorophenyl)-2-phenylsulfanylacetamide
CID 532041
2-(4-chlorophenyl)-N-[4-[2-(4-fluorophenyl)-2-oxoethyl]sulfanylphenyl]acetamide
CID 22776204
N-(4-acetylphenyl)-2-(4-fluorophenyl)sulfanylacetamide
CID 2194131
2-(4-chlorophenyl)sulfanyl-N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide
CID 4566393
N-[4-[2-(4-chloroanilino)-2-oxoethyl]sulfanylphenyl]-3,3-dimethylbutanamide
CID 19630200
N-(4-chlorophenyl)-2-naphthalen-2-ylsulfanylacetamide
CID 4560101
N-(4-fluorophenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanylacetamide
CID 19712820
N-[4-(2-anilino-2-oxoethyl)sulfanylphenyl]-2-(4-chlorophenyl)acetamide
CID 22775721
2-(4-chlorophenyl)sulfanyl-N-[4-(cyanomethyl)phenyl]acetamide
CID 7603938
4-fluoro-N-[4-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanylphenyl]benzamide
CID 22777816
N-(3,4-difluorophenyl)-2-[[2-(4-fluorophenyl)sulfanylacetyl]amino]acetamide
CID 26560428

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide (CID 738704) is 2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide is O=C(CSc1ccc(Cl)cc1)Nc1ccc(F)cc1.
What is the InChIKey of 2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide?
The InChIKey is URICZDJRKRXLCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFNOS/c15-10-1-7-13(8-2-10)19-9-14(18)17-12-5-3-11(16)4-6-12/h1-8H,9H2,(H,17,18).
What are the key properties of 2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide?
2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide has a molecular weight of 295.77 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 738704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).