Basic information
- Standard SMILES
NC(=S)Nc1ncc(Br)nc1OCc1ccccc1- InChIKey
UMWHCVGWJRNLLQ-UHFFFAOYSA-N- Molecular formula
- C12H11BrN4OS
- Average molar mass
- 339.21 g/mol
Names & identifiers
- Preferred name
- 1-(3-(Benzyloxy)-5-bromopyrazin-2-yl)thiourea
- IUPAC
- (5-bromo-3-phenylmethoxypyrazin-2-yl)thiourea
Names & synonyms
SCHEMBL2337875UMWHCVGWJRNLLQ-UHFFFAOYSA-N1-(3-(benzyloxy)-5-bromopyrazin-2-yl)thiourea
Database identifiers
- PubChem CID
- 86639655
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 301
Related reactions
3 records
Compound notes
Loading…