Compound C25H24N2O3

12,13-dimethoxy-7-phenyl-7,9,10,14b-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-6-one

CAS: 54971-45-8

Molecular Formula	`C25H24N2O3`
Molecular Weight	400.5 g/mol
LogP	4.1
Topological Polar Surface Area	50.8 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	3
Exact Mass	400.17868
Heavy Atoms	30
Complexity	607.0

Chemical Identifiers

CAS Number	54971-45-8
SMILES	`COC1=C(C=C2C3C4=CC=CC=C4NC(=O)C(N3CCC2=C1)C5=CC=CC=C5)OC`
InChIKey	`FSOFEJREGFIHQG-UHFFFAOYSA-N`

📖 Product Overview

Compound C25H24N2O3 (CAS: 54971-45-8) is a chemical compound with molecular formula C25H24N2O3 and molecular weight 400.5 g/mol. Its IUPAC systematic name is 12,13-dimethoxy-7-phenyl-7,9,10,14b-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-6-one. LogP 4.1 Topological Polar Surface Area 50.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 3 Exact Mass 400.17868 Heavy Atoms 30 Complexity 607.0 InChI Key: FSOFEJREGFIHQG-UHFFFAOYSA-N. SMILES: COC1=C(C=C2C3C4=CC=CC=C4NC(=O)C(N3CCC2=C1)C5=CC=CC=C5)OC.

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