4-(dimethylamino)-1-phenyl-8-(trifluoromethyl)-3H-1,5-benzodiazepin-2-one

CAS: 36985-47-4

Molecular Formula	`C18H16F3N3O`
Molecular Weight	347.3 g/mol
LogP	3.1
Topological Polar Surface Area	35.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	2
Exact Mass	347.12454
Heavy Atoms	25
Complexity	526.0

Chemical Identifiers

CAS Number	36985-47-4
SMILES	`CN(C)C1=NC2=C(C=C(C=C2)C(F)(F)F)N(C(=O)C1)C3=CC=CC=C3`
InChIKey	`JPKQTZQKHUBTAW-UHFFFAOYSA-N`

📖 Product Overview

4-(dimethylamino)-1-phenyl-8-(trifluoromethyl)-3H-1,5-benzodiazepin-2-one (CAS: 36985-47-4) is a chemical compound with molecular formula C18H16F3N3O and molecular weight 347.3 g/mol. Its IUPAC systematic name is 4-(dimethylamino)-1-phenyl-8-(trifluoromethyl)-3H-1,5-benzodiazepin-2-one. LogP 3.1 Topological Polar Surface Area 35.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 2 Exact Mass 347.12454 Heavy Atoms 25 Complexity 526.0 InChI Key: JPKQTZQKHUBTAW-UHFFFAOYSA-N. SMILES: CN(C)C1=NC2=C(C=C(C=C2)C(F)(F)F)N(C(=O)C1)C3=CC=CC=C3.

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