Molecules/Diethyl 2-((3-dimethylcarbamoyl-4-((4'-trifluoromethylbiphenyl-2-carbonyl)amino)phenyl)acetyloxymethyl)-2-phenylmalonate
Diethyl 2-((3-dimethylcarbamoyl-4-((4'-trifluoromethylbiphenyl-2-carbonyl)amino)phenyl)acetyloxymethyl)-2-phenylmalonate
diethyl 2-[[2-[3-(dimethylcarbamoyl)-4-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]phenyl]acetyl]oxymethyl]-2-phenylpropanedioate
Molecular Identity
Diethyl 2-((3-dimethylcarbamoyl-4-((4'-trifluoromethylbiphenyl-2-carbonyl)amino)phenyl)acetyloxymethyl)-2-phenylmalonate
diethyl 2-[[2-[3-(dimethylcarbamoyl)-4-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]phenyl]acetyl]oxymethyl]-2-phenylpropanedioate
PubChem CID: 11607299
2D Structure
Properties
C39H37F3N2O8
Molecular Formula
718.70
Molecular Weight
g/mol
718.2502
Exact Mass
Da
7.2
XLogP
Above Lipinski threshold
128
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
11
H-Bond Acceptors
1210
Complexity
SMILES
Canonical SMILES
SMILES: CCOC(=O)C(COC(=O)CC1=CC(=C(C=C1)NC(=O)C2=CC=CC=C2C3=CC=C(C=C3)C(F)(F)F)C(=O)N(C)C)(C4=CC=CC=C4)C(=O)OCCIsomeric SMILES
SMILES: CCOC(=O)C(COC(=O)CC1=CC(=C(C=C1)NC(=O)C2=CC=CC=C2C3=CC=C(C=C3)C(F)(F)F)C(=O)N(C)C)(C4=CC=CC=C4)C(=O)OCCSynonyms(20)
Diethyl 2-((3-dimethylcarbamoyl-4-((4'-trifluoromethylbiphenyl-2-carbonyl)amino)phenyl)acetyloxymethyl)-2-phenylmalonateRefChem:920150Granotapide594842-13-4Granotapide [INN]JTT-130PSZ2YGB0DKUNII-PSZ2YGB0DK916683-32-4diethyl 2-[[2-[3-(dimethylcarbamoyl)-4-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]phenyl]acetyl]oxymethyl]-2-phenylpropanedioateJTT130diethyl 2-({2-[3-(dimethylcarbamoyl)-4-{4'-(trifluoromethyl)-[1,1'-biphenyl]-2-carboxamido}phenyl]acetyloxy}methyl)-2-phenylpropanedioateJTT 130GranotapidaDIETHYL 2-((2-(3-(DIMETHYLCARBAMOYL)-4-(4'-(TRIFLUOROMETHYL)-(1,1'-BIPHENYL)-2-CARBOXAMIDO)PHENYL)ACETYLOXY)METHYL)-2-PHENYLPROPANEDIOATE
Data from PubChem (NCBI)
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Molecular Structure
Diethyl 2-((3-dimethylcarbamoyl-4-((4'-trifluoromethylbiphenyl-2-carbonyl)amino)phenyl)acetyloxymethyl)-2-phenylmalonate
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Drug Network
Trials and conditions connected to Diethyl 2-((3-dimethylcarbamoyl-4-((4'-trifluoromethylbiphenyl-2-carbonyl)amino)phenyl)acetyloxymethyl)-2-phenylmalonate
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