Basic information
- CAS
68142-70-1- Standard SMILES
Cc1nnc(-n2c(-c3ccccc3)nc3ccccc3c2=O)s1- InChIKey
PGLZQSKRVACWSR-UHFFFAOYSA-N- Molecular formula
- C17H12N4OS
- Average molar mass
- 320.4 g/mol
- Monoisotopic mass
- 320.07318219
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(5-methyl-1,3,4-thiadiazol-2-yl)-2-phenyl-
- IUPAC
- 3-(5-methyl-1,3,4-thiadiazol-2-yl)-2-phenylquinazolin-4-one
Names & synonyms
68142-70-1BRN 10863854(3H)-Quinazolinone, 3-(5-methyl-1,3,4-thiadiazol-2-yl)-2-phenyl-3-(5-Methyl-1,3,4-thiadiazol-2-yl)-2-phenyl-4(3H)-quinazolinoneDTXSID60218321RefChem:284126DTXCID801408123-(5-methyl-1,3,4-thiadiazol-2-yl)-2-phenylquinazolin-4(3H)-one3-(5-methyl-1,3,4-thiadiazol-2-yl)-2-phenyl-3,4-dihydroquinazolin-4-one
Database identifiers
- CAS
68142-70-1- PubChem CID
- 63809
- DTXSID
DTXSID60218321
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 86.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 491
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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