4-(2-Benzoyloxyethylamino)-2-methyl-1-oxo-1,2-dihydrophthalazine
Basic information
- CAS
73632-87-8- Standard SMILES
Cn1nc(NCCOC(=O)c2ccccc2)c2ccccc2c1=O- InChIKey
KAIPDJMNNLJFGN-UHFFFAOYSA-N- Molecular formula
- C18H17N3O3
- Average molar mass
- 323.3 g/mol
- Monoisotopic mass
- 323.12699141
Names & identifiers
- Preferred name
- 4-(2-Benzoyloxyethylamino)-2-methyl-1-oxo-1,2-dihydrophthalazine
- IUPAC
- 2-[(3-methyl-4-oxophthalazin-1-yl)amino]ethyl benzoate
- English name
- 4-(2-Benzoyloxyethylamino)-2-methyl-1-oxo-1,2-dihydrophthalazine
- Molecular weight
- 0
Names & synonyms
4-(2-Benzoyloxyethylamino)-2-methyl-1-oxo-1,2-dihydrophthalazine73632-87-8DTXSID20348032RefChem:287091DTXCID50299104KAIPDJMNNLJFGN-UHFFFAOYSA-N2-[(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)amino]ethyl benzoate2-[(3-Methyl-4-oxo-3,4-dihydro-1-phthalazinyl)amino]ethyl benzoate #
Database identifiers
- CAS
73632-87-8- PubChem CID
- 629587
- DTXSID
DTXSID20348032- Nikkaji
- J581.578I
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 71 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 500
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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