Completing data — usually done within a minute
Basic information
- CAS
875340-16-2- Standard SMILES
O=C(c1cc2nccc(Oc3ccc([N+](=O)[O-])cc3F)c2s1)N1CCCC1- InChIKey
OYZOICORPQVKKH-UHFFFAOYSA-N- Molecular formula
- C18H14FN3O4S
- Average molar mass
- 387.4 g/mol
- Monoisotopic mass
- 387.06890527
Names & identifiers
- Preferred name
- (7-(2-Fluoro-4-nitrophenoxy)thieno[3,2-b]pyridin-2-yl)(pyrrolidin-1-yl)methanone
- IUPAC
- [7-(2-fluoro-4-nitrophenoxy)thieno[3,2-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone
Names & synonyms
(7-(2-Fluoro-4-nitrophenoxy)thieno[3,2-b]pyridin-2-yl)(pyrrolidin-1-yl)methanone[7-(2-Fluoro-4-nitrophenoxy)thieno[3,2-b]pyridin-2-yl](pyrrolidin-1-yl)methanoneSCHEMBL308531OYZOICORPQVKKH-UHFFFAOYSA-NDTXSID301137423875340-16-2[7-(2-Fluoro-4-nitrophenoxy)thieno[3,2-b]pyridin-2-yl]-1-pyrrolidinylmethanone
Database identifiers
- CAS
875340-16-2- PubChem CID
- 59424552
- DTXSID
DTXSID301137423
Properties
Computed structural propertiesFilling in
- XLogP
- 3.7
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 571
Related reactions
10 records
Compound notes
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