4(3H)-Quinazolinone, 7-chloro-3-(3,5-dimethylyphenyl)-2-methyl-
Basic information
- CAS
74101-58-9- Standard SMILES
Cc1cc(C)cc(-n2c(C)nc3cc(Cl)ccc3c2=O)c1- InChIKey
SGOMEBCYUDQCQT-UHFFFAOYSA-N- Molecular formula
- C17H15ClN2O
- Average molar mass
- 298.8 g/mol
- Monoisotopic mass
- 298.0872908
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 7-chloro-3-(3,5-dimethylyphenyl)-2-methyl-
- IUPAC
- 7-chloro-3-(3,5-dimethylphenyl)-2-methylquinazolin-4-one
Names & synonyms
BRN 08894677-Chloro-3-(3,5-dimethylphenyl)-2-methyl-4(3H)-quinazolinone4(3H)-Quinazolinone, 7-chloro-3-(3,5-dimethylyphenyl)-2-methyl-74101-58-9DTXSID702250415-24-03-00188 (Beilstein Handbook Reference)RefChem:284331DTXCID701475327-chloro-3-(3,5-dimethylphenyl)-2-methylquinazolin-4(3H)-one
Database identifiers
- CAS
74101-58-9- PubChem CID
- 63539
- DTXSID
DTXSID70225041
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 440
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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