Benzamide, 4-methoxy-N-[[[4-(2-phenyldiazenyl)phenyl]amino]thioxomethyl]-
Basic information
- CAS
875193-37-6- Standard SMILES
COc1ccc(C(=O)NC(=S)Nc2ccc(N=Nc3ccccc3)cc2)cc1- InChIKey
NUYASOBNCWJPRX-UHFFFAOYSA-N- Molecular formula
- C21H18N4O2S
- Average molar mass
- 390.5 g/mol
- Monoisotopic mass
- 390.115047
Names & identifiers
- Preferred name
- Benzamide, 4-methoxy-N-[[[4-(2-phenyldiazenyl)phenyl]amino]thioxomethyl]-
- IUPAC
- 4-methoxy-N-[(4-phenyldiazenylphenyl)carbamothioyl]benzamide
Names & synonyms
DTXSID501039633AKOS003448802Benzamide, 4-methoxy-N-[[[4-(2-phenyldiazenyl)phenyl]amino]thioxomethyl]-875193-37-6
Database identifiers
- CAS
875193-37-6- PubChem CID
- 4939701
- DTXSID
DTXSID501039633
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 535
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Compound notes
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