2-[3-(1,3-benzodioxol-5-yl)-4-oxoquinazolin-2-yl]sulfanyl-N-ethyl-N-(3-methylphenyl)acetamide
Basic information
- CAS
6195-80-8- Standard SMILES
CCN(C(=O)CSc1nc2ccccc2c(=O)n1-c1ccc2c(c1)OCO2)c1cccc(C)c1- InChIKey
IJOIKXKFAMYOBG-UHFFFAOYSA-N- Molecular formula
- C26H23N3O4S
- Average molar mass
- 473.5 g/mol
- Monoisotopic mass
- 473.1409274
Names & identifiers
- Preferred name
- 2-[3-(1,3-benzodioxol-5-yl)-4-oxoquinazolin-2-yl]sulfanyl-N-ethyl-N-(3-methylphenyl)acetamide
- IUPAC
- 2-[3-(1,3-benzodioxol-5-yl)-4-oxoquinazolin-2-yl]sulfanyl-N-ethyl-N-(3-methylphenyl)acetamide
Names & synonyms
6195-80-82-(3-benzo[1,3]dioxol-5-yl-4-oxo-quinazolin-2-yl)sulfanyl-N-ethyl-N-(3-methylphenyl)acetamide2-[3-(1,3-benzodioxol-5-yl)-4-oxoquinazolin-2-yl]sulfanyl-N-ethyl-N-(3-methylphenyl)acetamideOprea1_435535DTXSID00409599AKOS002086466SR-01000557813SR-01000557813-12-{[3-(2H-1,3-BENZODIOXOL-5-YL)-4-OXO-3,4-DIHYDROQUINAZOLIN-2-YL]SULFANYL}-N-ETHYL-N-(3-METHYLPHENYL)ACETAMIDE
Database identifiers
- CAS
6195-80-8- PubChem CID
- 5202265
- DTXSID
DTXSID00409599
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 96.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 792
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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