BRN 0711853

1-(4-fluorophenyl)-4-(10-methoxy-6-methyl-1,2,4,5-tetrahydroazepino[4,5-b]indol-3-yl)butan-1-one

CAS: 24441-77-8

Molecular Formula	`C24H27FN2O2`
Molecular Weight	394.5 g/mol
LogP	4.1
Topological Polar Surface Area	34.5 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	6
Exact Mass	394.20566
Heavy Atoms	29
Complexity	551.0

Chemical Identifiers

CAS Number	24441-77-8
SMILES	`CN1C2=C(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C4=C1C=CC=C4OC`
InChIKey	`JYMLYFYFQOJKFX-UHFFFAOYSA-N`

📖 Product Overview

BRN 0711853 (CAS: 24441-77-8) is a chemical compound with molecular formula C24H27FN2O2 and molecular weight 394.5 g/mol. Its IUPAC systematic name is 1-(4-fluorophenyl)-4-(10-methoxy-6-methyl-1,2,4,5-tetrahydroazepino[4,5-b]indol-3-yl)butan-1-one. LogP 4.1 Topological Polar Surface Area 34.5 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 6 Exact Mass 394.20566 Heavy Atoms 29 Complexity 551.0 InChI Key: JYMLYFYFQOJKFX-UHFFFAOYSA-N. SMILES: CN1C2=C(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C4=C1C=CC=C4OC.

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