1-(4-Methylbenzamido)-2-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)acetylamino]-anthraquinone

HCID 53374686
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Basic information

Standard SMILES
Cc1ccc(C(=O)Nc2c(NC(=O)CN3CCC4(CC3)OCCO4)ccc3c2C(=O)c2ccccc2C3=O)cc1
InChIKey
ZHYONYIUZIXHLB-UHFFFAOYSA-N
Molecular formula
C31H29N3O6
Average molar mass
539.6 g/mol

Names & identifiers

Preferred name
1-(4-Methylbenzamido)-2-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)acetylamino]-anthraquinone
IUPAC
N-[2-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-9,10-dioxoanthracen-1-yl]-4-methylbenzamide

Names & synonyms

SCHEMBL2272387ZHYONYIUZIXHLB-UHFFFAOYSA-N1-(4-methylbenzamido)-2-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)acetylamino]-anthraquinone

Database identifiers

PubChem CID
53374686

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
114 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
40

Related reactions

2 records
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Compound notes

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