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4-chloro-N-(thiophen-2-ylmethyl)benzamide

HCID 722286
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Basic information

Standard SMILES
O=C(NCc1cccs1)c1ccc(Cl)cc1
InChIKey
OPXTXCLTXQNTQH-UHFFFAOYSA-N
Molecular formula
C12H10ClNOS
Average molar mass
251.73 g/mol

Names & identifiers

Preferred name
4-chloro-N-(thiophen-2-ylmethyl)benzamide
IUPAC
4-chloro-N-(thiophen-2-ylmethyl)benzamide

Names & synonyms

4-chloro-N-(thiophen-2-ylmethyl)benzamide332082-86-74-Chloro-N-thiophen-2-ylmethyl-benzamideSCHEMBL2400629SCHEMBL3604498OPXTXCLTXQNTQH-UHFFFAOYSA-NHMS1665M20AKOS001259364DB-332281ST51026897(4-chlorophenyl)-N-(2-thienylmethyl)carboxamideZ29693717

Database identifiers

PubChem CID
722286

Properties

Computed structural properties

XLogP
3
Topological polar surface area
57.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
16
Formal charge
0
Complexity
241

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Related reactions

11 records
New reaction record
HRID 89115 reaction equation
HRID 89115As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 805623 reaction equation
HRID 805623As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 906634 reaction equation
HRID 906634As productuspto-grants-2011_09
HRID 908541 reaction equation
HRID 908541As productuspto-grants-2011_09
HRID 1869264 reaction equation
HRID 1869264As productuspto-grants-2009_12
HRID 1869265 reaction equation
HRID 1869265As reactantuspto-grants-2009_12
HRID 1984564 reaction equation
HRID 1984564As productuspto-grants-2009_06
HRID 1984565 reaction equation
HRID 1984565As reactantuspto-grants-2009_06
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Compound notes

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