Basic information
- CAS
439946-29-9- Standard SMILES
COc1ccc(C2=CSC3=NCCN23)cc1Cl- InChIKey
KTZHDOBEYCEISF-UHFFFAOYSA-N- Molecular formula
- C12H11ClN2OS
- Average molar mass
- 266.75 g/mol
- Monoisotopic mass
- 266.0280618
Names & identifiers
- Preferred name
- 3-(3-Chloro-4-methoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
- IUPAC
- 3-(3-chloro-4-methoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
Names & synonyms
3-(3-chloro-4-methoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole439946-29-9MLS001208419CHEMBL1606321DTXSID7013258403-(3-Chloro-4-methoxy-phenyl)-5,6-dihydro-imidazo[2,1-b]thiazoleSTK841817AKOS000591132SMR000518448EU-0010525ST50271300SR-01000484870
Show more names
SR-01000484870-13-(3-chloro-4-methoxyphenyl)-5,6-dihydroimidazo[2,1-b]thiazole3-(3-CHLORO-4-METHOXYPHENYL)-5H,6H-IMIDAZO[2,1-B][1,3]THIAZOLE
Database identifiers
- CAS
439946-29-9- PubChem CID
- 720498
- DTXSID
DTXSID701325840- ChEMBL
CHEMBL1606321
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 50.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 372
Experimental & physicochemical properties
Solubility38.4 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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