3-(2-chloro-6-fluorophenyl)-N-[3-[3-(2-chloro-6-fluorophenyl)prop-2-enoylamino]-4-phenyldiazenylphenyl]prop-2-enamide
Basic information
- CAS
548452-93-3- Standard SMILES
O=C(C=Cc1c(F)cccc1Cl)Nc1ccc(N=Nc2ccccc2)c(NC(=O)C=Cc2c(F)cccc2Cl)c1- InChIKey
HTKVSMTWANDRKR-UHFFFAOYSA-N- Molecular formula
- C30H20Cl2F2N4O2
- Average molar mass
- 577.4 g/mol
- Monoisotopic mass
- 576.0931376
Names & identifiers
- Preferred name
- 3-(2-chloro-6-fluorophenyl)-N-[3-[3-(2-chloro-6-fluorophenyl)prop-2-enoylamino]-4-phenyldiazenylphenyl]prop-2-enamide
- IUPAC
- 3-(2-chloro-6-fluorophenyl)-N-[3-[3-(2-chloro-6-fluorophenyl)prop-2-enoylamino]-4-phenyldiazenylphenyl]prop-2-enamide
Names & synonyms
DTXSID101038669548452-93-32-Propenamide, N,N'-[4-(phenylazo)-1,3-phenylene]bis[3-(2-chloro-6-fluorophenyl)- (9CI)
Database identifiers
- CAS
548452-93-3- PubChem CID
- 4597288
- DTXSID
DTXSID101038669
Properties
Computed structural properties
- XLogP
- 7.7
- Topological polar surface area
- 82.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 929
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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