Basic information
- CAS
32701-17-0- Standard SMILES
O=c1c2cc(I)ccc2nc2[nH]c3ccccc3n12- InChIKey
GFYBDLLHTVOEHC-UHFFFAOYSA-N- Molecular formula
- C14H8IN3O
- Average molar mass
- 361.14 g/mol
- Monoisotopic mass
- 360.97121
Names & identifiers
- Preferred name
- Benzimidazo(2,1-b)quinazolin-12(6H)-one, 2-iodo-
- IUPAC
- 2-iodo-6H-benzimidazolo[2,1-b]quinazolin-12-one
Names & synonyms
BRN 0618446Benzimidazo(2,1-b)quinazolin-12(6H)-one, 2-iodo-2-iodobenzimidazo[2,1-b]quinazolin-12(6h)-one32701-17-02-Iodobenzimidazo(2,1-b)quinazolin-12(6H)-oneDTXSID00186378RefChem:325767DTXCID10108869SCHEMBL118341812-Iodo[1,3]benzimidazo[2,1-b]quinazolin-12(6H)-one
Database identifiers
- CAS
32701-17-0- PubChem CID
- 208644
- DTXSID
DTXSID00186378
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 44.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 438
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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