10-(1-methyl-4-piperidinylidene)-10H-thieno[3,2-d]-1,2,4-triazolo[4,3-a]azepine

HCID 23355014
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Basic information

Standard SMILES
CN1CCC(=C2c3ccsc3C=Cn3cnnc32)CC1
InChIKey
JOXMRZDOPCUYFA-UHFFFAOYSA-N
Molecular formula
C15H16N4S
Average molar mass
284.4 g/mol

Names & identifiers

Preferred name
10-(1-methyl-4-piperidinylidene)-10H-thieno[3,2-d]-1,2,4-triazolo[4,3-a]azepine
IUPAC
2-(1-methylpiperidin-4-ylidene)-11-thia-4,5,7-triazatricyclo[8.3.0.03,7]trideca-1(10),3,5,8,12-pentaene

Names & synonyms

SCHEMBL7047510JOXMRZDOPCUYFA-UHFFFAOYSA-N10-(1-methyl-4-piperidinylidene)-10H-thieno[3,2-d]-1,2,4-triazolo[4,3-a]azepine

Database identifiers

PubChem CID
23355014

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
62.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
20

Related reactions

1 records
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Compound notes

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