N-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide

C14H10F3NOS — CID 7284421

IUPACN-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide
SMILESO=C(CSc1ccc(F)cc1)Nc1c(F)cccc1F
InChIInChI=1S/C14H10F3NOS/c15-9-4-6-10(7-5-9)20-8-13(19)18-14-11(16)2-1-3-12(14)17/h1-7H,8H2,(H,18,19)
InChIKeyPJLZSMSNWODRIQ-UHFFFAOYSA-N
MW297.30 g/mol
LogP3.83
Rot. Bonds4

About N-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide

N-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide (PubChem CID 7284421) has the molecular formula C14H10F3NOS and a molecular weight of 297.30 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide
PubChem CID7284421
Molecular FormulaC14H10F3NOS
Molecular Weight297.30 g/mol
Exact Mass297.04
IUPAC NameN-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide
SMILESO=C(CSc1ccc(F)cc1)Nc1c(F)cccc1F
InChIInChI=1S/C14H10F3NOS/c15-9-4-6-10(7-5-9)20-8-13(19)18-14-11(16)2-1-3-12(14)17/h1-7H,8H2,(H,18,19)
InChIKeyPJLZSMSNWODRIQ-UHFFFAOYSA-N
XLogP3.83
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.30
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-difluorophenyl)-2-phenylsulfanylacetamide
CID 956399
2-phenylsulfanyl-N-(2,4,6-trifluorophenyl)acetamide
CID 167825999
2-(4-chlorophenyl)sulfanyl-N-(4-fluorophenyl)acetamide
CID 738704
N-(4-fluorophenyl)-2-phenylsulfanylacetamide
CID 532041
N-(2,6-difluorophenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetamide
CID 7976693
2-(4-fluorophenyl)sulfanyl-N-(2-iodophenyl)acetamide
CID 2704723
N-(2,6-difluorophenyl)-2-(2,3,5,6-tetramethylphenyl)sulfanylacetamide
CID 7468628
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(4-fluorophenyl)sulfanylacetamide
CID 4791415
N-(4-fluorophenyl)-2-(4-methylphenyl)sulfanylacetamide
CID 2824699
2-(2,5-dichlorophenyl)sulfanyl-N-(2,6-difluorophenyl)acetamide
CID 2536490
N-(2-chloro-4,6-dimethylphenyl)-2-(4-fluorophenyl)sulfanylacetamide
CID 2704735
1-(2-fluorophenyl)-3-[[2-(4-fluorophenyl)sulfanylacetyl]amino]thiourea
CID 9468573

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide?
The IUPAC name of N-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide (CID 7284421) is N-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide?
The canonical SMILES for N-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide is O=C(CSc1ccc(F)cc1)Nc1c(F)cccc1F.
What is the InChIKey of N-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide?
The InChIKey is PJLZSMSNWODRIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F3NOS/c15-9-4-6-10(7-5-9)20-8-13(19)18-14-11(16)2-1-3-12(14)17/h1-7H,8H2,(H,18,19).
What are the key properties of N-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide?
N-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide has a molecular weight of 297.30 g/mol, XLogP of 3.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide is sourced from PubChem (CID 7284421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).