3-Hydroxy-2-phenyl-quinazoline-4-thione
Basic information
- CAS
13961-53-0- Standard SMILES
On1c(-c2ccccc2)nc2ccccc2c1=S- InChIKey
KNLKNECMXAABMH-UHFFFAOYSA-N- Molecular formula
- C14H10N2OS
- Average molar mass
- 254.31 g/mol
- Monoisotopic mass
- 254.05138412
Names & identifiers
- Preferred name
- 3-Hydroxy-2-phenyl-quinazoline-4-thione
- IUPAC
- 3-hydroxy-2-phenylquinazoline-4-thione
Names & synonyms
NSC68546213961-53-03-hydroxy-2-phenyl-quinazoline-4-thioneCHEMBL1989191DTXSID10327775AKOS016036704NSC-685462NCI60_0307343-Hydroxy-2-phenyl-4(3H)-quinazolinethione3-Hydroxy-2-phenylquinazoline-4(3H)-thione
Database identifiers
- CAS
13961-53-0- PubChem CID
- 389396
- DTXSID
DTXSID10327775- ChEMBL
CHEMBL1989191
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 67.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 363
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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