Benzamide,N-[2-hydrazinylidene-4-(4-methoxyphenyl)-1(2H)-pyrimidinyl]-
Basic information
- CAS
127252-15-7- Standard SMILES
COc1ccc(-c2ccn(NC(=O)c3ccccc3)c(=NN)n2)cc1- InChIKey
FZNIUVFIQZBBAN-UHFFFAOYSA-N- Molecular formula
- C18H17N5O2
- Average molar mass
- 335.4 g/mol
- Monoisotopic mass
- 335.1382248
Names & identifiers
- Preferred name
- Benzamide,N-[2-hydrazinylidene-4-(4-methoxyphenyl)-1(2H)-pyrimidinyl]-
- IUPAC
- N-[2-hydrazinylidene-4-(4-methoxyphenyl)pyrimidin-1-yl]benzamide
- English name
- N-[2-Hydrazono-4-(4-methoxyphenyl)-1H,2H-pyrimidin-1-yl]-benzamide
- Molecular formula
- C18H17N5O2
- Molecular weight
- 335.36
Names & synonyms
127252-15-7Benzamide,N-[2-hydrazinylidene-4-(4-methoxyphenyl)-1(2H)-pyrimidinyl]-N-[2-hydrazinylidene-4-(4-methoxyphenyl)pyrimidin-1-yl]benzamideDTXSID80339325N-[2-Hydrazinylidene-4-(4-methoxyphenyl)pyrimidin-1(2H)-yl]benzamideN-[2-Hydrazono-4-(4-methoxyphenyl)-1H,2H-pyrimidin-1-yl]-benzamide
Database identifiers
- CAS
127252-15-7- PubChem CID
- 555404
- DTXSID
DTXSID80339325
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 92.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 558
Physicochemical properties
- Melting point
- 211 · 211-213 °C(Solvent: Ethanol)
- Density
- 1.283 · 1.283±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 10.15 · 10.150±0.20(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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