4-(3-Chloro-4-methoxyphenyl)-2-[1-(morpholine-4-carbonyl)piperidin-4-yl]-4a,5,8,8a-tetrahydrophthalazin-1-one

HCID 18436669
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Basic information

Standard SMILES
COc1ccc(C2=NN(C3CCN(C(=O)N4CCOCC4)CC3)C(=O)C3CC=CCC23)cc1Cl
InChIKey
DTRSYKTUTDYBBR-UHFFFAOYSA-N
Molecular formula
C25H31ClN4O4
Average molar mass
487 g/mol

Names & identifiers

Preferred name
4-(3-Chloro-4-methoxyphenyl)-2-[1-(morpholine-4-carbonyl)piperidin-4-yl]-4a,5,8,8a-tetrahydrophthalazin-1-one
IUPAC
4-(3-chloro-4-methoxyphenyl)-2-[1-(morpholine-4-carbonyl)piperidin-4-yl]-4a,5,8,8a-tetrahydrophthalazin-1-one

Names & synonyms

SCHEMBL5564655

Database identifiers

PubChem CID
18436669

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
74.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
34

Related reactions

1 records
New reaction record

Linked notes

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