Basic information
- Standard SMILES
Cc1cc(Cl)cc2nn(CC(C)(C#N)NC(=O)c3ccc(Oc4ccccc4)cc3)nc12- InChIKey
VIOQDDRJSHVYOD-UHFFFAOYSA-N- Molecular formula
- C24H20ClN5O2
- Average molar mass
- 445.9 g/mol
Names & identifiers
- Preferred name
- N-[2-(6-Chloro-4-methyl-2H-benzotriazol-2-yl)-1-cyano-1-methylethyl]-4-phenoxybenzamide
- IUPAC
- N-[1-(6-chloro-4-methylbenzotriazol-2-yl)-2-cyanopropan-2-yl]-4-phenoxybenzamide
Names & synonyms
SCHEMBL204143VIOQDDRJSHVYOD-UHFFFAOYSA-NN-[2-(6-Chloro-4-methyl-2H-benzotriazol-2-yl)-1-cyano-1-methylethyl]-4-phenoxybenzamide
Database identifiers
- PubChem CID
- 66620488
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 92.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 700
Related reactions
5 records
Compound notes
Loading…