8-[2-(4-Chloro-2,5-difluorophenyl)thieno[3,2-d]pyrimidine-4-yl]-1,4-dioxa-8-azaspiro[4,5]decane
Basic information
- Standard SMILES
Fc1cc(-c2nc(N3CCC4(CC3)OCCO4)c3sccc3n2)c(F)cc1Cl- InChIKey
CEJFMXZLRLALFC-UHFFFAOYSA-N- Molecular formula
- C19H16ClF2N3O2S
- Average molar mass
- 423.9 g/mol
Names & identifiers
- Preferred name
- 8-[2-(4-Chloro-2,5-difluorophenyl)thieno[3,2-d]pyrimidine-4-yl]-1,4-dioxa-8-azaspiro[4,5]decane
- IUPAC
- 8-[2-(4-chloro-2,5-difluorophenyl)thieno[3,2-d]pyrimidin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane
Names & synonyms
SCHEMBL4526792CEJFMXZLRLALFC-UHFFFAOYSA-N8-[2-(4-chloro-2,5-difluorophenyl)thieno[3,2-d]pyrimidine-4-yl]-1,4-dioxa-8-azaspiro[4,5]decane8-[2-(4-chloro-2,5-difluorophenyl)thieno[3,2-d]pyrimidine-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane
Database identifiers
- PubChem CID
- 69079359
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 563
Related reactions
1 records
Compound notes
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