Compound C32H28N6O

7-[(2-cyano-4-phenyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-7-yl)oxy]-4-phenyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-2-carbonitrile

CAS: 87896-38-6

Molecular Formula	`C32H28N6O`
Molecular Weight	512.6 g/mol
LogP	6.3
Topological Polar Surface Area	105.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	7
Rotatable Bonds	4
Exact Mass	512.2325
Heavy Atoms	39
Complexity	825.0

Chemical Identifiers

CAS Number	87896-38-6
SMILES	`C1C(NC2=C(C=C(C=C2)OC3=CC4=C(C=C3)NC(CC(N4)C5=CC=CC=C5)C#N)NC1C6=CC=CC=C6)C#N`
InChIKey	`XEUWCQPDKQCPQM-UHFFFAOYSA-N`

📖 Product Overview

Compound C32H28N6O (CAS: 87896-38-6) is a chemical compound with molecular formula C32H28N6O and molecular weight 512.6 g/mol. Its IUPAC systematic name is 7-[(2-cyano-4-phenyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-7-yl)oxy]-4-phenyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-2-carbonitrile. LogP 6.3 Topological Polar Surface Area 105.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 7 Rotatable Bonds 4 Exact Mass 512.2325 Heavy Atoms 39 Complexity 825.0 InChI Key: XEUWCQPDKQCPQM-UHFFFAOYSA-N. SMILES: C1C(NC2=C(C=C(C=C2)OC3=CC4=C(C=C3)NC(CC(N4)C5=CC=CC=C5)C#N)NC1C6=CC=CC=C6)C#N.

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