4-N-benzhydryl-3-nitropyridine-2,4,6-triamine
Basic information
- CAS
6506-85-0- Standard SMILES
Nc1cc(NC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c(N)n1- InChIKey
LGRZYOMDJCERLI-UHFFFAOYSA-N- Molecular formula
- C18H17N5O2
- Average molar mass
- 335.4 g/mol
- Monoisotopic mass
- 335.1382248
Names & identifiers
- Preferred name
- 4-N-benzhydryl-3-nitropyridine-2,4,6-triamine
- IUPAC
- 4-N-benzhydryl-3-nitropyridine-2,4,6-triamine
Names & synonyms
6506-85-04-N-benzhydryl-3-nitropyridine-2,4,6-triamineNSC166558DTXSID60304632NSC-166558N~4~-(Diphenylmethyl)-3-nitropyridine-2,4,6-triamine
Database identifiers
- CAS
6506-85-0- PubChem CID
- 296414
- DTXSID
DTXSID60304632
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 414
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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