PPACK II diTFA

For research use only. Not for therapeutic Use.

  • CAT Number: I011793
  • CAS Number: 649748-23-2
  • Molecular Formula: C29H35ClF6N6O7
  • Molecular Weight: 729.07
  • Purity: ≥95%
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PPACK II diTFA (Cat No.:I011793) is a synthetic inhibitor of serine proteases, particularly targeting thrombin, a key enzyme in the blood coagulation cascade. It is used in research to study blood clotting, thrombosis, and related diseases. The diTFA (trifluoroacetate) component enhances the solubility and stability of the compound, making it more effective for laboratory applications. PPACK II diTFA is valuable in anticoagulant studies and the development of new therapeutic agents to manage clotting disorders. Its safety and potential for clinical use require further investigation through clinical trials.


Catalog Number I011793
CAS Number 649748-23-2
Synonyms

(2R)-2-amino-N-[(2S)-1-[[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]-3-phenylpropanamide;2,2,2-trifluoroacetic acid

Molecular Formula C29H35ClF6N6O7
Purity ≥95%
IUPAC Name (2R)-2-amino-N-[(2S)-1-[[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]-3-phenylpropanamide;2,2,2-trifluoroacetic acid
InChI InChI=1S/C25H33ClN6O3.2C2HF3O2/c26-16-22(33)20(12-7-13-30-25(28)29)31-24(35)21(15-18-10-5-2-6-11-18)32-23(34)19(27)14-17-8-3-1-4-9-17;2*3-2(4,5)1(6)7/h1-6,8-11,19-21H,7,12-16,27H2,(H,31,35)(H,32,34)(H4,28,29,30);2*(H,6,7)/t19-,20+,21+;;/m1../s1
InChIKey JVMDQRDDGVKUMG-WOSURGFKSA-N
SMILES C1=CC=C(C=C1)C[C@H](C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCCN=C(N)N)C(=O)CCl)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

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