3-[(3-Fluorobenzyl)sulfanyl]-6-propoxypyridazine
Basic information
- CAS
5273-55-2- Standard SMILES
CCCOc1ccc(SCc2cccc(F)c2)nn1- InChIKey
ZXUGIWMSKWZTSP-UHFFFAOYSA-N- Molecular formula
- C14H15FN2OS
- Average molar mass
- 278.35 g/mol
- Monoisotopic mass
- 278.08891244
Names & identifiers
- Preferred name
- 3-[(3-Fluorobenzyl)sulfanyl]-6-propoxypyridazine
- IUPAC
- 3-[(3-fluorophenyl)methylsulfanyl]-6-propoxypyridazine
Names & synonyms
5273-55-23-[(3-fluorobenzyl)sulfanyl]-6-propoxypyridazineNSC69038DTXSID60290501NSC-690383-{[(3-FLUOROPHENYL)METHYL]SULFANYL}-6-PROPOXYPYRIDAZINE
Database identifiers
- CAS
5273-55-2- PubChem CID
- 250050
- DTXSID
DTXSID60290501
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 60.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 258
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…