5-(5-{[1-(2-Methoxy-ethyl)-piperidin-4-ylamino]-methyl}-3-pyridin-4-yl-furan-2-yl)-indan-1-one oxime

HCID 136355250
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Basic information

Standard SMILES
COCCN1CCC(NCc2cc(-c3ccncc3)c(-c3ccc4c(c3)CCC4=NO)o2)CC1
InChIKey
HMJDHFZIVQBUFB-UHFFFAOYSA-N
Molecular formula
C27H32N4O3
Average molar mass
460.6 g/mol

Names & identifiers

Preferred name
5-(5-{[1-(2-Methoxy-ethyl)-piperidin-4-ylamino]-methyl}-3-pyridin-4-yl-furan-2-yl)-indan-1-one oxime
IUPAC
N-[5-[5-[[[1-(2-methoxyethyl)piperidin-4-yl]amino]methyl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]hydroxylamine

Names & synonyms

SCHEMBL5115221HMJDHFZIVQBUFB-UHFFFAOYSA-N5-(5-{[1-(2-Methoxy-ethyl)-piperidin-4-ylamino]-methyl}-3-pyridin-4-yl-furan-2-yl)-indan-1-one oxime

Database identifiers

PubChem CID
136355250

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
83.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
34

Related reactions

2 records
New reaction record

Compound notes

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