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N-(Glycylglycyl)-N-methyl-2',5-dichloro-2-amino-benzophenone hydrate

HCID 54759
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Basic information

CAS
101651-52-9
Standard SMILES
CN(C(=O)CNC(=O)CN)c1ccc(Cl)cc1C(=O)c1ccccc1Cl.O
InChIKey
KZEVFNKHTIQLJK-UHFFFAOYSA-N
Molecular formula
C18H19Cl2N3O4
Average molar mass
412.3 g/mol
Monoisotopic mass
411.0752615

Names & identifiers

Preferred name
N-(Glycylglycyl)-N-methyl-2',5-dichloro-2-amino-benzophenone hydrate
IUPAC
2-amino-N-[2-[4-chloro-2-(2-chlorobenzoyl)-N-methylanilino]-2-oxoethyl]acetamide;hydrate
English name
Lorzafone [USAN:INN]
Molecular formula
C18H19Cl2N3O4
Molecular weight
412.26716

Names & synonyms

N-(Glycylglycyl)-N-methyl-2',5-dichloro-2-amino-benzophenone hydrate101651-52-945-0088-SGlycyl-N-(4-chloro-2-(2-chlorobenzoyl)phenyl)-N-methylglycinamide hydrate2-o-Chlorbenzoyl-4-chlor-N-methyl-N(sup alpha)-glycylglycinanilid-hydrat [German]2-o-Chlorobenzoyl-4-chloro-N-methyl-N(sup alpha)-glycylglycinanilide hydrateGlycinamide, glycyl-N-(4-chloro-2-(2-chlorobenzoyl)phenyl)-N-methyl-, hydrate2-amino-N-[2-[4-chloro-2-(2-chlorobenzoyl)-N-methylanilino]-2-oxoethyl]acetamide;hydrateAcetanilide, 2-(2-aminoacetamido)-2'-(o-chlorobenzoyl)-4'-chloro-N-methyl-, hydrate2-o-Chlorbenzoyl-4-chlor-N-methyl-N(sup alpha)-glycylglycinanilid-hydratlorzafone hydrateLorzafone [USAN
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Lorzafone [USAN:INN]
SCHEMBL637185CHEMBL3989552DTXSID409064312-[(2-aminoacetyl)amino]-N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methylacetamide hydrateD04782Q272794952-Amino-N-(2-{[4-chloro-2-(2-chlorobenzoyl)phenyl](methyl)amino}-2-oxoethyl)ethanimidic acid--water (1/1)Amino-N-(2-{[4-chloro-2-(2-chlorobenzoyl)phenyl](methyl)amino}-2-oxoethyl)ethanimidic acid--water (1/1)

Database identifiers

CAS
101651-52-9、81603-65-8
PubChem CID
54759
DTXSID
DTXSID40906431
ChEMBL
CHEMBL3989552
UNII
H19UP2X8L2

Properties

Computed structural properties

Topological polar surface area
93.5 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
27
Formal charge
0
Complexity
532

Physicochemical properties

FDA UNII
19 UP2X8L2 · H19UP2X8L2

Chemistry & industry

Applications

UsesTranquilizer (minor).

Related reactions

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Compound notes

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