Basic information
- Standard SMILES
O=C(Cc1noc2ccccc12)Nn1nc(N2CCOCC2)c2ccccc2c1=O- InChIKey
LJYNEPAFCPUIER-UHFFFAOYSA-N- Molecular formula
- C21H19N5O4
- Average molar mass
- 405.4 g/mol
- Monoisotopic mass
- 405.1437041
Names & identifiers
- Preferred name
- 2-(1,2-benzoxazol-3-yl)-N-[4-(morpholin-4-yl)-1-oxophthalazin-2(1H)-yl]acetamide
- IUPAC
- 2-(1,2-benzoxazol-3-yl)-N-(4-morpholin-4-yl-1-oxophthalazin-2-yl)acetamide
Names & synonyms
SCHEMBL13721244LJYNEPAFCPUIER-UHFFFAOYSA-N2-(1,2-benzoxazol-3-yl)-N-[4-(morpholin-4-yl)-1-oxophthalazin-2(1H)-yl]acetamide
Database identifiers
- PubChem CID
- 70976162
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 695
Related reactions
1 records
Compound notes
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