Basic information
- CAS
4449-73-4- Standard SMILES
Cc1ccccc1-n1c(C)nc2ccc(I)cc2c1=O- InChIKey
FTIBNTFGONFSTH-UHFFFAOYSA-N- Molecular formula
- C16H13IN2O
- Average molar mass
- 376.19 g/mol
- Monoisotopic mass
- 376.00726
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 6-iodo-2-methyl-3-(2-methylphenyl)-
- IUPAC
- 6-iodo-2-methyl-3-(2-methylphenyl)quinazolin-4-one
Names & synonyms
4449-73-44(3H)-Quinazolinone, 6-iodo-2-methyl-3-(2-methylphenyl)-6-iodo-2-methyl-3-(2-methylphenyl)quinazolin-4-one6-Iodo-2-methyl-3-(2-methylphenyl)-4(3H)-quinazolinone6-iodo-2-methyl-3-(2-methylphenyl)quinazolin-4(3H)-oneBRN 02399646-iodo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-oneDTXSID60196195STK833331AKOS005623309SR-01000264962SR-01000264962-1
Database identifiers
- CAS
4449-73-4- PubChem CID
- 64052
- DTXSID
DTXSID60196195
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 423
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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