Basic information
- CAS
478171-86-7- Standard SMILES
O=c1oc2ccc(Cl)cc2cc1-c1cn2ccsc2n1- InChIKey
XMVLBIGDGOEAST-UHFFFAOYSA-N- Molecular formula
- C14H7ClN2O2S
- Average molar mass
- 302.7 g/mol
- Monoisotopic mass
- 301.9916763
Names & identifiers
- Preferred name
- 2H-1-Benzopyran-2-one, 6-chloro-3-imidazo[2,1-b]thiazol-6-yl-
- IUPAC
- 6-chloro-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one
Names & synonyms
478171-86-7NSC7183202H-1-Benzopyran-2-one, 6-chloro-3-imidazo[2,1-b]thiazol-6-yl-CHEMBL1975657DTXSID00328039NSC-718320NCI60_0407706-Chloro-3-(imidazo[2,1-b][1,3]thiazol-6-yl)-2H-1-benzopyran-2-one
Database identifiers
- CAS
478171-86-7- PubChem CID
- 403453
- DTXSID
DTXSID00328039- ChEMBL
CHEMBL1975657
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 71.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 458
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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