CHEMBL3818994

4-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-fluorophenyl)butan-1-one

CAS: 15997-82-7

Molecular Formula	`C19H20FNO`
Molecular Weight	297.4 g/mol
LogP	3.6
Topological Polar Surface Area	20.3 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	5
Exact Mass	297.1529
Heavy Atoms	22
Complexity	364.0

Chemical Identifiers

CAS Number	15997-82-7
SMILES	`C1CN(CC2=CC=CC=C21)CCCC(=O)C3=CC=C(C=C3)F`
InChIKey	`NMALCZJKSYZTRE-UHFFFAOYSA-N`

📖 Product Overview

CHEMBL3818994 (CAS: 15997-82-7) is a chemical compound with molecular formula C19H20FNO and molecular weight 297.4 g/mol. Its IUPAC systematic name is 4-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-fluorophenyl)butan-1-one. LogP 3.6 Topological Polar Surface Area 20.3 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 5 Exact Mass 297.1529 Heavy Atoms 22 Complexity 364.0 InChI Key: NMALCZJKSYZTRE-UHFFFAOYSA-N. SMILES: C1CN(CC2=CC=CC=C21)CCCC(=O)C3=CC=C(C=C3)F.

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