CAS 159776-70-2: Melagatran

Formula: C₂₂H₃₁N₅O₄

InChI: InChI=1S/C22H31N5O4/c23-20(24)16-8-6-14(7-9-16)12-26-21(30)17-10-11-27(17)22(31)19(25-13-18(28)29)15-4-2-1-3-5-15/h6-9,15,17,19,25H,1-5,10-13H2,(H3,23,24)(H,26,30)(H,28,29)/t17-,19+/m0/s1

InChI key: InChIKey=DKWNMCUOEDMMIN-PKOBYXMFSA-N

SMILES: O=C(O)CNC(C(=O)N1CCC1C(=O)NCC2=CC=C(C=C2)C(=N)N)C3CCCCC3

Synonyms:

• Glycine, N-[(1R)-2-[(2S)-2-[[[[4-(aminoiminomethyl)phenyl]methyl]amino]carbonyl]-1-azetidinyl]-1-cyclohexyl-2-oxoethyl]-
• Glycine, N-[2-[2-[[[[4-(aminoiminomethyl)phenyl]methyl]amino]carbonyl]-1-azetidinyl]-1-cyclohexyl-2-oxoethyl]-, [S-(R*,S*)]-
• H-319/68
• N-[(1R)-2-[(2S)-2-[[[[4-(Aminoiminomethyl)phenyl]methyl]amino]carbonyl]-1-azetidinyl]-1-cyclohexyl-2-oxoethyl]glycine
• N-[(1R)-2-{(2S)-2-[(4-carbamimidoylbenzyl)carbamoyl]azetidin-1-yl}-1-cyclohexyl-2-oxoethyl]glycine
• Melagatran

Glycine, N-[(1R)-2-[(2S)-2-[[[[4-(aminoiminomethyl)phenyl]methyl]amino]carbonyl]-1-azetidinyl]-1-cyclohexyl-2-oxoethyl]-

CAS: 159776-70-2

• Formula: C₂₂H₃₁N₅O₄
• Purity: 98%
• Color and Shape: Solid
• Molecular weight: 429.5126

Melagatran

CAS: 159776-70-2

• Formula: C₂₂H₃₁N₅O₄
• Molecular weight: 429.52

Melagatran-d11

CAS: 159776-70-2

• Formula: C₂₂H₂₀D₁₁N₅O₄
• Molecular weight: 440.59

Melagatran

CAS: 159776-70-2

Stability Hygroscopic Applications Synthetic thrombin inhibitor. Thrombin mutant anticoagulant antagonist. Antithrombotic. References Dewanjee, M., et …

• Formula: C₂₂H₃₁N₅O₄
• Color and Shape: Neat
• Molecular weight: 429.51

Melagatran-d11

CAS: 159776-70-2

• Formula: C₂₂D₁₁H₂₀N₅O₄
• Color and Shape: Neat
• Molecular weight: 440.58

Melagatran

CAS: 159776-70-2

Melagatran is an orally available, direct synthetic thrombin inhibitor that does not require endogenous cofactors …

• Formula: C₂₂H₃₁N₅O₄
• Purity: 100% - 98.37%
• Color and Shape: Solid
• Molecular weight: 429.51

Melagatran

CAS: 159776-70-2

Melagatran is a coumarin derivative that acts as a thrombin receptor antagonist. It has been …

• Formula: C₂₂H₃₁N₅O₄
• Purity: Min. 95%
• Color and Shape: White Powder
• Molecular weight: 429.51 g/mol