Compound C23H24N6O

7-(2-cyano-4-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-7-carbonyl)-4-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-2-carbonitrile

CAS: 87896-43-3

Molecular Formula	`C23H24N6O`
Molecular Weight	400.5 g/mol
LogP	4.0
Topological Polar Surface Area	113.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	7
Rotatable Bonds	2
Exact Mass	400.20117
Heavy Atoms	30
Complexity	676.0

Chemical Identifiers

CAS Number	87896-43-3
SMILES	`CC1CC(NC2=C(N1)C=C(C=C2)C(=O)C3=CC4=C(C=C3)NC(CC(N4)C)C#N)C#N`
InChIKey	`MXKHSGSMNMWXGP-UHFFFAOYSA-N`

📖 Product Overview

Compound C23H24N6O (CAS: 87896-43-3) is a chemical compound with molecular formula C23H24N6O and molecular weight 400.5 g/mol. Its IUPAC systematic name is 7-(2-cyano-4-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-7-carbonyl)-4-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-2-carbonitrile. LogP 4.0 Topological Polar Surface Area 113.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 7 Rotatable Bonds 2 Exact Mass 400.20117 Heavy Atoms 30 Complexity 676.0 InChI Key: MXKHSGSMNMWXGP-UHFFFAOYSA-N. SMILES: CC1CC(NC2=C(N1)C=C(C=C2)C(=O)C3=CC4=C(C=C3)NC(CC(N4)C)C#N)C#N.

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