Basic information
- Standard SMILES
Clc1ncc(Br)c(-c2cccs2)n1- InChIKey
JVYDJRDLCCLRRJ-UHFFFAOYSA-N- Molecular formula
- C8H4BrClN2S
- Average molar mass
- 275.55 g/mol
- Monoisotopic mass
- 273.89671
Names & identifiers
- Preferred name
- 5-Bromo-2-chloro-4-(thiophen-2-yl)pyrimidine
- IUPAC
- 5-bromo-2-chloro-4-thiophen-2-ylpyrimidine
Names & synonyms
5-bromo-2-chloro-4-(thiophen-2-yl)pyrimidine884603-53-6SCHEMBL2965386JVYDJRDLCCLRRJ-UHFFFAOYSA-NDB-1183445-bromo-2-chloro-4-thiophen-2-ylpyrimidineEN300-8331942Z1862012787
Database identifiers
- PubChem CID
- 57428871
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 184
Related reactions
11 records
Compound notes
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