4-({3-[4-(Phenylcarbonyl)piperazin-1-yl]azetidin-1-yl}carbonyl)phenol

HCID 59625810
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Basic information

Standard SMILES
O=C(c1ccccc1)N1CCN(C2CN(C(=O)c3ccc(O)cc3)C2)CC1
InChIKey
XVAJJUKJCNLADN-UHFFFAOYSA-N
Molecular formula
C21H23N3O3
Average molar mass
365.4 g/mol
Monoisotopic mass
365.1739416

Names & identifiers

Preferred name
4-({3-[4-(Phenylcarbonyl)piperazin-1-yl]azetidin-1-yl}carbonyl)phenol
IUPAC
[4-[1-(4-hydroxybenzoyl)azetidin-3-yl]piperazin-1-yl]-phenylmethanone

Names & synonyms

SCHEMBL694039XVAJJUKJCNLADN-UHFFFAOYSA-N4-({3-[4-(Phenylcarbonyl)piperazin-1-yl]azetidin-1-yl}carbonyl)phenol

Database identifiers

PubChem CID
59625810

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
64.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
27

Related reactions

16 records
New reaction record

Compound notes

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4-({3-[4-(Phenylcarbonyl)piperazin-1-yl]azetidin-1-yl}carbonyl)phenol (HCID 59625810)｜Huagongshe