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Basic information
- Standard SMILES
CC1(C)N=C(c2ccccc2)c2ccsc2NC1=O- InChIKey
WUQFQGFXAWARLS-UHFFFAOYSA-N- Molecular formula
- C15H14N2OS
- Average molar mass
- 270.4 g/mol
Names & identifiers
- Preferred name
- 1,3-Dihydro-3,3-dimethyl-5-phenyl-2H-thieno[2,3-e]-1,4-diazepine-2-one
- IUPAC
- 3,3-dimethyl-5-phenyl-1H-thieno[2,3-e][1,4]diazepin-2-one
Names & synonyms
SCHEMBL2441159WUQFQGFXAWARLS-UHFFFAOYSA-N1,3-Dihydro-3,3-dimethyl-5-phenyl-2H-thieno[2,3-e]-1,4-diazepine-2-one
Database identifiers
- PubChem CID
- 136403161
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 69.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 399
Related reactions
1 records
Compound notes
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