Basic information
- Standard SMILES
COC(=O)NCCSc1cccc2nccn12- InChIKey
QKKBFLOFZMLBGI-UHFFFAOYSA-N- Molecular formula
- C11H13N3O2S
- Average molar mass
- 251.31 g/mol
- Monoisotopic mass
- 251.07284784
Names & identifiers
- Preferred name
- 5-[2-(Methoxycarbonylamino)ethylthio]imidazo[1,2-a]pyridine
- IUPAC
- methyl N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)carbamate
Names & synonyms
SCHEMBL9001977QKKBFLOFZMLBGI-UHFFFAOYSA-N5-[2-(methoxycarbonylamino)ethylthio]imidazo[1,2-a]pyridine
Database identifiers
- PubChem CID
- 9816411
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 265
Related reactions
6 records
Linked notes
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