Basic information
- CAS
136994-83-7- Standard SMILES
Brc1cccc(C2SCc3nc4ccccc4n32)c1- InChIKey
WMEXLDJBKXUZPX-UHFFFAOYSA-N- Molecular formula
- C15H11BrN2S
- Average molar mass
- 331.2 g/mol
- Monoisotopic mass
- 329.98263
Names & identifiers
- Preferred name
- 1-(3-Bromophenyl)-3H-[1,3]thiazolo[3,4-a]benzimidazole
- IUPAC
- 1-(3-bromophenyl)-1,3-dihydro-[1,3]thiazolo[3,4-a]benzimidazole
Names & synonyms
136994-83-7NSC6254741H,3H-Thiazolo(3,4-a)benzimidazole, 1-(3-bromophenyl)-1-(3-Bromophenyl)-3H-[1,3]thiazolo[3,4-a]benzimidazole1-(3-bromophenyl)-1,3-dihydrothiazolo[3,4-a]benzimidazole1H,3H-Thiazolo[3,4-a]benzimidazole, 1-(3-bromophenyl)-CHEMBL1992583DTXSID40929620NSC-625474NCI60_0078751-(3-Bromophenyl)-1H,3H-[1,3]thiazolo[3,4-a]benzimidazole1-(3-Bromophenyl)-1H,3H-[1,3]thiazolo[3,4-a][1,3]benzimidazole
Database identifiers
- CAS
136994-83-7- PubChem CID
- 361995
- DTXSID
DTXSID40929620- ChEMBL
CHEMBL1992583
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 340
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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