Basic information
- CAS
54883-32-8- Standard SMILES
Nc1ccc(-c2csc(-c3ccc(Cl)cc3)n2)cc1- InChIKey
LWHSCOLOVKIXEP-UHFFFAOYSA-N- Molecular formula
- C15H11ClN2S
- Average molar mass
- 286.8 g/mol
- Monoisotopic mass
- 286.0331472
Names & identifiers
- Preferred name
- 4-[2-(4-Chlorophenyl)-1,3-thiazol-4-yl]aniline
- IUPAC
- 4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]aniline
Names & synonyms
54883-32-84-[2-(4-Chlorophenyl)-1,3-thiazol-4-yl]aniline4-(2-(4-Chlorophenyl)thiazol-4-yl)anilineDTXSID90499262AKOS010521463CS-0283976EN300-238661
Database identifiers
- CAS
54883-32-8- PubChem CID
- 12463534
- DTXSID
DTXSID90499262
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 286
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…