Basic information
- CAS
1897-83-2- Standard SMILES
Cc1c(I)cccc1-n1c(C)nc2ccccc2c1=O- InChIKey
MTAXKWRNSMZEFG-UHFFFAOYSA-N- Molecular formula
- C16H13IN2O
- Average molar mass
- 376.19 g/mol
- Monoisotopic mass
- 376.00726
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(3-iodo-2-methylphenyl)-2-methyl-
- IUPAC
- 3-(3-iodo-2-methylphenyl)-2-methylquinazolin-4-one
Names & synonyms
4(3H)-Quinazolinone, 3-(3-iodo-2-methylphenyl)-2-methyl-1897-83-2B 236BRN 08075102-Methyl-3-(3-iodo-2-methylphenyl)-4(3H)-quinazolinone2-Methyl-3-(3'-jod-2'-methylphenyl)chinazolinone-(4) [German]2-Methyl-3-(3'-jod-2'-methylphenyl)chinazolinone-(4)3-(3-Iodo-2-methylphenyl)-2-methylquinazolin-4(3H)-oneDTXSID00172392
Database identifiers
- CAS
1897-83-2- PubChem CID
- 63370
- DTXSID
DTXSID00172392- Nikkaji
- J73.093I
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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