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2-[(4-Amino-3-methylphenyl)sulfanyl]-N-(3,4-difluorophenyl)acetamide

HCID 79128317
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Basic information

CAS
1511180-16-7
Standard SMILES
Cc1cc(SCC(=O)Nc2ccc(F)c(F)c2)ccc1N
InChIKey
KGVCLVZOHRKEOT-UHFFFAOYSA-N
Molecular formula
C15H14F2N2OS
Average molar mass
308.3 g/mol
Monoisotopic mass
308.07949057

Names & identifiers

Preferred name
2-[(4-Amino-3-methylphenyl)sulfanyl]-N-(3,4-difluorophenyl)acetamide
IUPAC
2-(4-amino-3-methylphenyl)sulfanyl-N-(3,4-difluorophenyl)acetamide

Names & synonyms

DTXSID201163352AKOS0176792902-[(4-Amino-3-methylphenyl)sulfanyl]-N-(3,4-difluorophenyl)acetamideAcetamide, 2-[(4-amino-3-methylphenyl)thio]-N-(3,4-difluorophenyl)-1511180-16-7

Database identifiers

CAS
1511180-16-7
PubChem CID
79128317
DTXSID
DTXSID201163352

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
80.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
21
Formal charge
0
Complexity
359

Related reactions

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Compound notes

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