Basic information
- CAS
64377-91-9- Standard SMILES
CC(C)NC(=O)CCCn1c(=O)c2ccccc2c(=O)n1C- InChIKey
JHJIDPLTDPUOLJ-UHFFFAOYSA-N- Molecular formula
- C16H21N3O3
- Average molar mass
- 303.36 g/mol
- Monoisotopic mass
- 303.15829154
Names & identifiers
- Preferred name
- 4-(3-methyl-1,4-dioxophthalazin-2-yl)-N-propan-2-ylbutanamide
- IUPAC
- 4-(3-methyl-1,4-dioxophthalazin-2-yl)-N-propan-2-ylbutanamide
Names & synonyms
NSC26797164377-91-9DTXSID30313231NSC-267971DS-0032032(1H)-PHTHALAZINEBUTANAMIDE,3,4-DIHYDRO-3-METHYL-N-(1-METHYLETHYL)-1,4-DIOXO-4-(3-Methyl-1,4-dioxo-3,4-dihydrophthalazin-2(1H)-yl)-N-(propan-2-yl)butanamide
Database identifiers
- CAS
64377-91-9- PubChem CID
- 320388
- DTXSID
DTXSID30313231
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 69.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 450
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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