4,7-Bis(3-hexylthiophen-2-yl)benzo[c][1,2,5]thiadiazole

HCID 56590608
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Basic information

Standard SMILES
CCCCCCc1ccsc1-c1ccc(-c2sccc2CCCCCC)c2nsnc12
InChIKey
HROONYYMVNHNIG-UHFFFAOYSA-N
Molecular formula
C26H32N2S3
Average molar mass
468.7 g/mol

Names & identifiers

Preferred name
4,7-Bis(3-hexylthiophen-2-yl)benzo[c][1,2,5]thiadiazole
IUPAC
4,7-bis(3-hexylthiophen-2-yl)-2,1,3-benzothiadiazole

Names & synonyms

SCHEMBL15502145HROONYYMVNHNIG-UHFFFAOYSA-N4,7-bis(3-hexylthiophen-2-yl)benzo[c][1,2,5]thiadiazole

Database identifiers

PubChem CID
56590608
Nikkaji
J3.003.384A

Properties

Computed structural properties

XLogP
10.4
Topological polar surface area
111 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
12
Heavy atoms
31

Related reactions

2 records
New reaction record

Linked notes

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