2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide

C14H10Cl3NO2S — CID 62000709

IUPAC2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide
SMILESO=C(CSc1ccccc1O)Nc1c(Cl)cc(Cl)cc1Cl
InChIInChI=1S/C14H10Cl3NO2S/c15-8-5-9(16)14(10(17)6-8)18-13(20)7-21-12-4-2-1-3-11(12)19/h1-6,19H,7H2,(H,18,20)
InChIKeyKXGULTKRMNOTJD-UHFFFAOYSA-N
MW362.67 g/mol
LogP5.08
Rot. Bonds4

About 2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide

2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide (PubChem CID 62000709) has the molecular formula C14H10Cl3NO2S and a molecular weight of 362.67 g/mol. Its IUPAC name is 2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide
PubChem CID62000709
Molecular FormulaC14H10Cl3NO2S
Molecular Weight362.67 g/mol
Exact Mass360.95
IUPAC Name2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide
SMILESO=C(CSc1ccccc1O)Nc1c(Cl)cc(Cl)cc1Cl
InChIInChI=1S/C14H10Cl3NO2S/c15-8-5-9(16)14(10(17)6-8)18-13(20)7-21-12-4-2-1-3-11(12)19/h1-6,19H,7H2,(H,18,20)
InChIKeyKXGULTKRMNOTJD-UHFFFAOYSA-N
XLogP5.08
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.67
LogP ≤ 55.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-amino-4-chlorophenyl)sulfanyl-N-(2,6-dichlorophenyl)acetamide
CID 43251034
2-(3-methylphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide
CID 60594383
2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide
CID 62000302
2-(2,5-dichlorophenyl)sulfanyl-N-(2,6-difluorophenyl)acetamide
CID 2536490
N-(2-chlorophenyl)-2-(2-chlorophenyl)sulfanylacetamide
CID 2498952
N-(2,6-dichlorophenyl)-2-phenylsulfanylacetamide
CID 963352
1-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-3-(2,4,6-trichlorophenyl)urea
CID 134102372
2-(2-chlorophenyl)sulfanyl-N-(2-hydroxy-5-nitrophenyl)acetamide
CID 112771769
2-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanyl-N-(2,4,6-trichlorophenyl)acetamide
CID 35987244
2-[4-oxo-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-(2,4,6-trichlorophenyl)acetamide
CID 23741013
2-(3-hydroxypropylsulfanyl)-N-(2,4,6-trichlorophenyl)acetamide
CID 66114967
[2-oxo-2-(2,4,6-trichloroanilino)ethyl] N'-aminocarbamimidothioate
CID 77061134

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide?
The IUPAC name of 2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide (CID 62000709) is 2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide.
What is the SMILES notation for 2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide?
The canonical SMILES for 2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide is O=C(CSc1ccccc1O)Nc1c(Cl)cc(Cl)cc1Cl.
What is the InChIKey of 2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide?
The InChIKey is KXGULTKRMNOTJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl3NO2S/c15-8-5-9(16)14(10(17)6-8)18-13(20)7-21-12-4-2-1-3-11(12)19/h1-6,19H,7H2,(H,18,20).
What are the key properties of 2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide?
2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide has a molecular weight of 362.67 g/mol, XLogP of 5.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide is sourced from PubChem (CID 62000709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).