2-(4-Chlorophenyl)-3-(3,5-dimethylphenyl)-1,2-dihydroquinazolin-4-one
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Basic information
- CAS
311784-22-2- Standard SMILES
Cc1cc(C)cc(N2C(=O)c3ccccc3NC2c2ccc(Cl)cc2)c1- InChIKey
LCVMYWVVPLOTCY-UHFFFAOYSA-N- Molecular formula
- C22H19ClN2O
- Average molar mass
- 362.8 g/mol
- Monoisotopic mass
- 362.1185909
Names & identifiers
- Preferred name
- 2-(4-Chlorophenyl)-3-(3,5-dimethylphenyl)-1,2-dihydroquinazolin-4-one
- IUPAC
- 2-(4-chlorophenyl)-3-(3,5-dimethylphenyl)-1,2-dihydroquinazolin-4-one
- English name
- 2-(4-chlorophenyl)-3-(3,5-dimethylphenyl)-2,3-dihydro-4(1H)-quinazolinone
- Molecular formula
- C22H19ClN2O
- Molecular weight
- 362.85
Names & synonyms
2-(4-chlorophenyl)-3-(3,5-dimethylphenyl)-1,2-dihydroquinazolin-4-one2-(4-chlorophenyl)-3-(3,5-dimethylphenyl)-2,3-dihydro-4(1H)-quinazolinoneTimTec1_005355Oprea1_3067272-(4-chlorophenyl)-3-(3,5-dimethylphenyl)-2,3-dihydroquinazolin-4(1H)-oneHMS1549D09STK168653AKOS000340641AKOS022013921NCGC00173299-01ST4032132AG-205/11552043
Show more names
4(1H)-Quinazolinone, 2-(4-chlorophenyl)-3-(3,5-dimethylphenyl)-2,3-dihydro-
SR-01000516829SR-01000516829-1
Database identifiers
- CAS
311784-22-2- PubChem CID
- 5139375
Properties
Computed structural propertiesFilling in
- XLogP
- 5.7
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 494
Physicochemical properties
- Boiling point
- 581.1 · 581.1±50.0 °C(Predicted)
- Density
- 1.239 · 1.239±0.06 g/cm3(Predicted)
- pka
- 0.53 · 0.53±0.40(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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