Basic information
- Standard SMILES
Br.Nc1nc2c(s1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1-2- InChIKey
XNINRPCUPAZFQA-UHFFFAOYSA-N- Molecular formula
- C31H25BrN4O2S
- Average molar mass
- 597.5 g/mol
Names & identifiers
- Preferred name
- 4'-[(2-amino-5,6-dihydro-4H-thiazolo(5,4-d][1]benzazepin-6-yl)carbonyl]-2-phenylbenzanilide hydrobromide
- IUPAC
- N-[4-(2-amino-4,5-dihydro-[1,3]thiazolo[5,4-d][1]benzazepine-6-carbonyl)phenyl]-2-phenylbenzamide;hydrobromide
Names & synonyms
4'-[(2-amino-5,6-dihydro-4H-thiazolo(5,4-d][1]benzazepin-6-yl)carbonyl]-2-phenylbenzanilide hydrobromide4'-[(2-amino-5,6-dihydro-4H-thiazolo[5,4-d][1]benzazepin-6-yl)carbonyl]-2-phenylbenzanilide hydrobromideSCHEMBL6995133XNINRPCUPAZFQA-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 86752185
Properties
Computed structural properties
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 827
Related reactions
2 records
Compound notes
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