1-(6-Bromo-2-benzothiazolyl)-3-ethylurea

HCID 21985564
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Basic information

Standard SMILES
CCNC(=O)Nc1nc2ccc(Br)cc2s1
InChIKey
CCOZLAKGZRSBNO-UHFFFAOYSA-N
Molecular formula
C10H10BrN3OS
Average molar mass
300.18 g/mol
Monoisotopic mass
298.9728

Names & identifiers

Preferred name
1-(6-Bromo-2-benzothiazolyl)-3-ethylurea
IUPAC
1-(6-bromo-1,3-benzothiazol-2-yl)-3-ethylurea

Names & synonyms

1-(6-Bromo-2-benzothiazolyl)-3-ethylureaSCHEMBL1303393CCOZLAKGZRSBNO-UHFFFAOYSA-N352528-01-9DB-3368321-(6-bromobenzo[d]thiazol-2-yl)-3-ethylureaN-(6-bromo-1,3-benzothiazol-2-yl)-N'-ethylureaF5772-7473

Database identifiers

PubChem CID
21985564

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
82.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
16

Related reactions

18 records
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Linked notes

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1-(6-Bromo-2-benzothiazolyl)-3-ethylurea (HCID 21985564)｜Huagongshe