N-(2-bromophenyl)-4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazine-1-carboxamide

HCID 68777907
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Basic information

Standard SMILES
O=C(Nc1ccccc1Br)N1CCN(c2nc(-c3ccccc3)ns2)CC1
InChIKey
OJOMMKJTLXDOGL-UHFFFAOYSA-N
Molecular formula
C19H18BrN5OS
Average molar mass
444.4 g/mol

Names & identifiers

Preferred name
N-(2-bromophenyl)-4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazine-1-carboxamide
IUPAC
N-(2-bromophenyl)-4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazine-1-carboxamide

Names & synonyms

SCHEMBL3765851OJOMMKJTLXDOGL-UHFFFAOYSA-NN-(2-bromophenyl)-4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazine-1-carboxamide

Database identifiers

PubChem CID
68777907

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
89.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
27

Related reactions

2 records
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Compound notes

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