Basic information
- CAS
1356783-21-5- Standard SMILES
CC(=O)c1c(C)[nH]c(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)c1C- InChIKey
CVMZXGUUNJLCOQ-UHFFFAOYSA-N- Molecular formula
- C21H20N4O2
- Average molar mass
- 360.4 g/mol
- Monoisotopic mass
- 360.15862589
Names & identifiers
- Preferred name
- 1H-Pyrrole-2-carboxamide, 4-acetyl-3,5-dimethyl-N-[4-(2-phenyldiazenyl)phenyl]-
- IUPAC
- 4-acetyl-3,5-dimethyl-N-(4-phenyldiazenylphenyl)-1H-pyrrole-2-carboxamide
Names & synonyms
DTXSID801037979AKOS0341310001H-Pyrrole-2-carboxamide, 4-acetyl-3,5-dimethyl-N-[4-(2-phenyldiazenyl)phenyl]-1356783-21-5Z30292848
Database identifiers
- CAS
1356783-21-5- PubChem CID
- 56777589
- DTXSID
DTXSID801037979
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 86.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 550
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…