N-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide

C14H8Cl2F3NOS — CID 55604341

IUPACN-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide
SMILESO=C(Nc1cc(Cl)ccc1Cl)c1ccccc1SC(F)(F)F
InChIInChI=1S/C14H8Cl2F3NOS/c15-8-5-6-10(16)11(7-8)20-13(21)9-3-1-2-4-12(9)22-14(17,18)19/h1-7H,(H,20,21)
InChIKeyACDWAUXEFKYFOU-UHFFFAOYSA-N
MW366.19 g/mol
LogP5.86
Rot. Bonds3

About N-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide

N-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide (PubChem CID 55604341) has the molecular formula C14H8Cl2F3NOS and a molecular weight of 366.19 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide
PubChem CID55604341
Molecular FormulaC14H8Cl2F3NOS
Molecular Weight366.19 g/mol
Exact Mass364.97
IUPAC NameN-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide
SMILESO=C(Nc1cc(Cl)ccc1Cl)c1ccccc1SC(F)(F)F
InChIInChI=1S/C14H8Cl2F3NOS/c15-8-5-6-10(16)11(7-8)20-13(21)9-3-1-2-4-12(9)22-14(17,18)19/h1-7H,(H,20,21)
InChIKeyACDWAUXEFKYFOU-UHFFFAOYSA-N
XLogP5.86
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.19
LogP ≤ 55.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chloro-2-fluorophenyl)-2-(trifluoromethylsulfanyl)benzamide
CID 47026174
N-(2,5-dichlorophenyl)-2-methylsulfanylbenzamide
CID 848431
N-(2,4-dichlorophenyl)-2-[[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]disulfanyl]benzamide
CID 6483556
methyl 2-[(2,5-dichlorophenyl)carbamoyl]benzoate
CID 108785394
N-(2,5-dichlorophenyl)-2-fluoro-3-methylbenzamide
CID 80717854
N-(4-acetamidophenyl)-2-(trifluoromethylsulfanyl)benzamide
CID 55604501
2-chloro-N-[4-chloro-2-(trifluoromethyl)phenyl]benzamide
CID 801601
N-(2,5-dichlorophenyl)benzamide;hydroiodide
CID 175991469
N-(2,4-dichlorophenyl)-2-propan-2-ylsulfanylbenzamide
CID 17224609
N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide
CID 113231148
2-amino-4-chloro-N-(2,5-dichlorophenyl)benzamide
CID 29037738
N-(2,5-dichlorophenyl)-2,4,5-trimethoxybenzamide
CID 1020033

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide?
The IUPAC name of N-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide (CID 55604341) is N-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide is O=C(Nc1cc(Cl)ccc1Cl)c1ccccc1SC(F)(F)F.
What is the InChIKey of N-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide?
The InChIKey is ACDWAUXEFKYFOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2F3NOS/c15-8-5-6-10(16)11(7-8)20-13(21)9-3-1-2-4-12(9)22-14(17,18)19/h1-7H,(H,20,21).
What are the key properties of N-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide?
N-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide has a molecular weight of 366.19 g/mol, XLogP of 5.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-2-(trifluoromethylsulfanyl)benzamide is sourced from PubChem (CID 55604341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).