N-Ethyl-N'-[6-(1H-1-pyrrolyl)-1,3-benzothiazol-2-yl]urea

HCID 21985656
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Basic information

Standard SMILES
CCNC(=O)Nc1nc2ccc(-n3cccc3)cc2s1
InChIKey
JNSVKRUIURFEEA-UHFFFAOYSA-N
Molecular formula
C14H14N4OS
Average molar mass
286.35 g/mol

Names & identifiers

Preferred name
N-Ethyl-N'-[6-(1H-1-pyrrolyl)-1,3-benzothiazol-2-yl]urea
IUPAC
1-ethyl-3-(6-pyrrol-1-yl-1,3-benzothiazol-2-yl)urea

Names & synonyms

SCHEMBL6068157JNSVKRUIURFEEA-UHFFFAOYSA-NN-Ethyl-N'-[6-(1H-1-pyrrolyl)-1,3-benzothiazol-2-yl]urea

Database identifiers

PubChem CID
21985656

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
87.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
20

Related reactions

1 records
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Compound notes

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