2-{1-[(4-[(Diphenylmethyl)amino]-6-{[ethoxy(hydroxy)methylidene]amino}-3-nitropyridin-2-yl)amino]propan-2-ylidene}hydrazine-1-carboximidic acid
Basic information
- CAS
6502-05-2- Standard SMILES
CCOC(=O)Nc1cc(NC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c(NCC(C)=NNC(N)=O)n1- InChIKey
HDNJZIUSDYFTPJ-UHFFFAOYSA-N- Molecular formula
- C25H28N8O5
- Average molar mass
- 520.5 g/mol
- Monoisotopic mass
- 520.21826602
Names & identifiers
- Preferred name
- 2-{1-[(4-[(Diphenylmethyl)amino]-6-{[ethoxy(hydroxy)methylidene]amino}-3-nitropyridin-2-yl)amino]propan-2-ylidene}hydrazine-1-carboximidic acid
- IUPAC
- ethyl N-[4-(benzhydrylamino)-6-[2-(carbamoylhydrazinylidene)propylamino]-5-nitro-2-pyridinyl]carbamate
Names & synonyms
6502-05-2DTXSID009835662-{1-[(4-[(Diphenylmethyl)amino]-6-{[ethoxy(hydroxy)methylidene]amino}-3-nitropyridin-2-yl)amino]propan-2-ylidene}hydrazine-1-carboximidic acid
Database identifiers
- CAS
6502-05-2- PubChem CID
- 262117
- DTXSID
DTXSID00983566
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 189 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 11
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 792
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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