Guanidine, 1-cyclopropyl-2-(2-methyl-4-quinolyl)-3-(2-thiazolyl)-, dinitrate
Basic information
- CAS
71079-56-6- Standard SMILES
Cc1cc(N=C([NH2+]c2nccs2)[NH2+]C2CC2)c2ccccc2n1.O=[N+]([O-])[O-].O=[N+]([O-])[O-]- InChIKey
RGEXPZAMHBJKCW-UHFFFAOYSA-P- Molecular formula
- C17H19N7O6S
- Average molar mass
- 449.4 g/mol
- Monoisotopic mass
- 449.11175252
Names & identifiers
- Preferred name
- Guanidine, 1-cyclopropyl-2-(2-methyl-4-quinolyl)-3-(2-thiazolyl)-, dinitrate
- IUPAC
- cyclopropyl-[N-(2-methylquinolin-4-yl)-C-(1,3-thiazol-2-ylazaniumyl)carbonimidoyl]azanium dinitrate
Names & synonyms
71079-56-61-Cyclopropyl-2-(2-methyl-4-quinolyl)-3-(2-thiazolyl)guanidine dinitrateGUANIDINE, 1-CYCLOPROPYL-2-(2-METHYL-4-QUINOLYL)-3-(2-THIAZOLYL)-, DINITRATERefChem:346892
Database identifiers
- CAS
71079-56-6- PubChem CID
- 51238
Properties
Computed structural properties
- Topological polar surface area
- 225 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 457
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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