Basic information
- CAS
122341-74-6- Standard SMILES
COc1ccc([N+](=O)[O-])cc1CN=C(N)NC(=O)c1nc(Cl)c(N)nc1N- InChIKey
FUWFKBHKVULDCP-UHFFFAOYSA-N- Molecular formula
- C14H15ClN8O4
- Average molar mass
- 394.77 g/mol
- Monoisotopic mass
- 394.0904787
Names & identifiers
- Preferred name
- 2'-Methoxy-5'-nitrobenzamil
- IUPAC
- 3,5-diamino-6-chloro-N-[N'-[(2-methoxy-5-nitrophenyl)methyl]carbamimidoyl]pyrazine-2-carboxamide
- English name
- 2'-methoxy-5'-nitrobenzamil
- Molecular formula
- C14H15ClN8O4
- Molecular weight
- 394.77
Names & synonyms
MN-Benzamil2'-Methoxy-5'-nitrobenzamil122341-74-6DTXSID20153582RefChem:80391DTXCID20760733,5-Diamino-6-chloro-N-(imino(((2-methoxy-5-nitrophenyl)methyl)amino)methyl)pyrazinecarboxamide3,5-Diamino-6-chloro-N-{N'-[(2-methoxy-5-nitrophenyl)methyl]carbamimidoyl}pyrazine-2-carboxamidePyrazinecarboxamide, 3,5-diamino-6-chloro-N-(imino(((2-methoxy-5-nitrophenyl)methyl)amino)methyl)-2-Pyrazinecarboxamide, 3,5-diamino-6-chloro-N-[imino[[(2-methoxy-5-nitrophenyl)methyl]amino]methyl]-
Database identifiers
- CAS
122341-74-6- PubChem CID
- 129702
- DTXSID
DTXSID20153582
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 200 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 574
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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