Basic information
- Standard SMILES
CC(C)(C)OC(=O)N(CCS(C)(=O)=O)c1nccn2c(Br)cnc12- InChIKey
WXFPMULTTBRJHY-UHFFFAOYSA-N- Molecular formula
- C14H19BrN4O4S
- Average molar mass
- 419.3 g/mol
Names & identifiers
- Preferred name
- (3-Bromo-imidazo[1,2-a]pyrazin-8-yl)-(2-methanesulfonyl-ethyl)-carbamic acid tert-butyl ester
- IUPAC
- tert-butyl N-(3-bromoimidazo[1,2-a]pyrazin-8-yl)-N-(2-methylsulfonylethyl)carbamate
Names & synonyms
SCHEMBL12272586WXFPMULTTBRJHY-UHFFFAOYSA-N(3-bromo-imidazo[1,2-a]pyrazin-8-yl)-(2-methanesulfonyl-ethyl)-carbamic acid tert-butyl ester
Database identifiers
- PubChem CID
- 68226902
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 560
Related reactions
5 records
Compound notes
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