Basic information
- Standard SMILES
CCCCOCCOCCOc1nsnc1-c1cccnc1- InChIKey
KGPWQMDXSCDBMS-UHFFFAOYSA-N- Molecular formula
- C15H21N3O3S
- Average molar mass
- 323.4 g/mol
- Monoisotopic mass
- 323.13036271
Names & identifiers
- Preferred name
- 3-(3-(2-(2-Butoxyethoxy)ethoxy)-1,2,5-thiadiazol-4-yl)pyridine
- IUPAC
- 3-[2-(2-butoxyethoxy)ethoxy]-4-pyridin-3-yl-1,2,5-thiadiazole
Names & synonyms
SCHEMBL7611132KGPWQMDXSCDBMS-UHFFFAOYSA-N3-(3-(2-(2-butoxyethoxy)-ethoxy)-1,2,5-thiadiazol-4-yl)pyridine3-(3-(2-(2-Butoxyethoxy)ethoxy)-1,2,5-thiadiazol-4-yl)pyridine3-(4-(2-(2-butoxyethoxy) ethoxy)-1,2,5-thiadiazol-3-yl)pyridine3-(4-(2-(2-butoxyethoxy)ethoxy)-1,2,5-thiadiazol-3-yl)pyridine3- (4- (2-(2-butoxyethoxy )ethoxy )-1,2,5-thiadiazol-3-yl)pyridine
Database identifiers
- PubChem CID
- 19075324
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 94.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 287
Related reactions
30 records
Linked notes
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