3-Butylthio-4-(3-azetidinyloxy)-1,2,5-thiadiazole

HCID 19600355
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Basic information

Standard SMILES
CCCCSc1nsnc1OC1CNC1
InChIKey
DYWGQNMNDMGOMW-UHFFFAOYSA-N
Molecular formula
C9H15N3OS2
Average molar mass
245.4 g/mol
Monoisotopic mass
245.06565446

Names & identifiers

Preferred name
3-Butylthio-4-(3-azetidinyloxy)-1,2,5-thiadiazole
IUPAC
3-(azetidin-3-yloxy)-4-butylsulfanyl-1,2,5-thiadiazole

Names & synonyms

SCHEMBL6917356DYWGQNMNDMGOMW-UHFFFAOYSA-N3-Butylthio-4-(3-azetidinyloxy)-1,2,5-thiadiazole

Database identifiers

PubChem CID
19600355

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
101 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
15

Related reactions

8 records
New reaction record

Linked notes

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