Basic information
- CAS
452090-25-4- Standard SMILES
Cc1csc(=Nc2ccc(F)cc2F)n1C(C)C- InChIKey
DDDBUPFWCKVTCF-UHFFFAOYSA-N- Molecular formula
- C13H14F2N2S
- Average molar mass
- 268.33 g/mol
- Monoisotopic mass
- 268.08457595
Names & identifiers
- Preferred name
- (2Z)-N-(2,4-Difluorophenyl)-4-methyl-3-(propan-2-yl)-1,3-thiazol-2(3H)-imine
- IUPAC
- N-(2,4-difluorophenyl)-4-methyl-3-propan-2-yl-1,3-thiazol-2-imine
Names & synonyms
452090-25-4DTXSID90719659(2Z)-N-(2,4-Difluorophenyl)-4-methyl-3-(propan-2-yl)-1,3-thiazol-2(3H)-imine
Database identifiers
- CAS
452090-25-4- PubChem CID
- 56972607
- DTXSID
DTXSID90719659
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 40.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 368
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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