Basic information
- CAS
74875-78-8- Standard SMILES
O=C1CSC(=Nc2ccccc2)N1Cn1cnc2ccccc2c1=O- InChIKey
PCGDZYBZQDIEET-UHFFFAOYSA-N- Molecular formula
- C18H14N4O2S
- Average molar mass
- 350.4 g/mol
- Monoisotopic mass
- 350.08374688
Names & identifiers
- Preferred name
- 3-[[4-Oxo-2-(phenylimino)-3-thiazolidinyl]methyl]-4(3H)-quinazolinone
- IUPAC
- 3-[(4-oxoquinazolin-3-yl)methyl]-2-phenylimino-1,3-thiazolidin-4-one
Names & synonyms
74875-78-83-[[4-Oxo-2-(phenylimino)-3-thiazolidinyl]methyl]-4(3H)-quinazolinone3-((4-Oxo-2-(phenylimino)-3-thiazolidinyl)methyl)-4(3H)-quinazolinoneRefChem:272991BRN 49471614(3H)-Quinazolinone, 3-((4-oxo-2-phenyliminothiazolidin-3-yl)methyl)-3-(4-Oxo-2-phenyliminothiazolidin-3-yl)methyl-4(3H)quinazolinoneDTXSID1011570293-{[4-Oxo-2-(phenylimino)-1,3-thiazolidin-3-yl]methyl}quinazolin-4(3H)-one
Database identifiers
- CAS
74875-78-8- PubChem CID
- 63548
- DTXSID
DTXSID101157029- Nikkaji
- J73.432B
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 90.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 600
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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