Basic information
- CAS
79451-60-8- Standard SMILES
CC(=O)Nc1ccc(N=Nc2c(C)nn(C(=N)N)c2C)cc1- InChIKey
FZAHFRKWXFRCFL-UHFFFAOYSA-N- Molecular formula
- C14H17N7O
- Average molar mass
- 299.33 g/mol
- Monoisotopic mass
- 299.14945819
Names & identifiers
- Preferred name
- N-[4-(1-Carbamimidoyl-3,5-dimethyl-pyrazol-4-YL)diazenylphenyl]acetamide
- IUPAC
- N-[4-[(1-carbamimidoyl-3,5-dimethylpyrazol-4-yl)diazenyl]phenyl]acetamide
Names & synonyms
79451-60-8NSC263639N-[4-(1-CARBAMIMIDOYL-3,5-DIMETHYL-PYRAZOL-4-YL)DIAZENYLPHENYL]ACETAMIDEDTXSID30330468N-[4-[(E)-(1-carbamimidoyl-3,5-dimethyl-pyrazol-4-yl)azo]phenyl]acetamideN-{4-[(E)-(1-Carbamimidoyl-3,5-dimethyl-1H-pyrazol-4-yl)diazenyl]phenyl}acetamideAcetamide, N-[4-[[1-(aminoiminomethyl)-3,5-dimethyl-1H-pyrazol-4-yl]azo]phenyl]-, monohydrochloride
Database identifiers
- CAS
79451-60-8- PubChem CID
- 429720
- DTXSID
DTXSID30330468
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 444
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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