1-(2-Methylphenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Basic information
- CAS
1264526-13-7- Standard SMILES
Cc1ccccc1-n1c(=S)[nH]c(=O)c2ccccc21- InChIKey
INSLPKDTFCEQAM-UHFFFAOYSA-N- Molecular formula
- C15H12N2OS
- Average molar mass
- 268.3 g/mol
- Monoisotopic mass
- 268.06703418
Names & identifiers
- Preferred name
- 1-(2-Methylphenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
- IUPAC
- 1-(2-methylphenyl)-2-sulfanylidenequinazolin-4-one
Names & synonyms
DTXSID0011824554(1H)-Quinazolinone, 2,3-dihydro-1-(2-methylphenyl)-2-thioxo-1-(2-Methylphenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one1264526-13-7
Database identifiers
- CAS
1264526-13-7- PubChem CID
- 102415732
- DTXSID
DTXSID001182455- Nikkaji
- J2.913.716A
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 384
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Compound notes
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