2-(Chloromethyl)-2-Methyl-3-Phenyl-1,2,3,4-Tetrahydroquinazolin-4-One
Basic information
- CAS
217461-83-1- Standard SMILES
CC1(CCl)Nc2ccccc2C(=O)N1c1ccccc1- InChIKey
WDVPQLGNNTUOLD-UHFFFAOYSA-N- Molecular formula
- C16H15ClN2O
- Average molar mass
- 286.75 g/mol
- Monoisotopic mass
- 286.0872908
Names & identifiers
- Preferred name
- 2-(Chloromethyl)-2-Methyl-3-Phenyl-1,2,3,4-Tetrahydroquinazolin-4-One
- IUPAC
- 2-(chloromethyl)-2-methyl-3-phenyl-1H-quinazolin-4-one
- English name
- 2-(Chloromethyl)-2-methyl-3-phenyl-1,2,3,4-tetrahydroquinazolin-4-one
- Molecular formula
- C16H15ClN2O
- Molecular weight
- 286.76
Names & synonyms
217461-83-12-(Chloromethyl)-2-Methyl-3-Phenyl-1,2,3,4-Tetrahydroquinazolin-4-One2-(Chloromethyl)-2-methyl-3-phenyl-2,3-dihydroquinazolin-4(1H)-one2-(chloromethyl)-2-methyl-3-phenyl-1H-quinazolin-4-oneNSC319429DTXSID10317616AKOS001254220AKOS016897133NSC-319429Z1906629904(1H)-Quinazolinone, 2-(chloromethyl)-2,3-dihydro-2-methyl-3-phenyl-
Database identifiers
- CAS
217461-83-1- PubChem CID
- 330495
- DTXSID
DTXSID10317616
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 369
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Compound notes
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