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The molecular formula is C21H20N2.
Some synonyms include 2-BIPHENYL-4-YL-2,3,4,5-TETRAHYDRO-1H-BENZO[B][1,4]DIAZEPINE and 4-(4-phenylphenyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine.
The molecular weight is 300.4 g/mol.
The IUPAC name is 4-(4-phenylphenyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine.
The InChI is InChI=1S/C21H20N2/c1-2-6-16(7-3-1)17-10-12-18(13-11-17)19-14-15-22-20-8-4-5-9-21(20)23-19/h1-13,19,22-23H,14-15H2.
The InChIKey is HNWHNOSPLHNHNX-UHFFFAOYSA-N.
The Canonical SMILES is C1CNC2=CC=CC=C2NC1C3=CC=C(C=C3)C4=CC=CC=C4.
The XLogP3-AA value is 5.2.
There are 2 hydrogen bond donor counts.
Yes, the compound is canonicalized.
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904814-66-0
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904815-00-5
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