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Atecegatran metoxil

Atecegatran metoxil

  • CAT Number: I003139
  • CAS Number: 433937-93-0
  • Molecular Formula: C22H23ClF2N4O5
  • Molecular Weight: 496.8958
  • Purity: ≥95%
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Atecegatran metoxil, also known as Atecegatran fexenetil and AZD0837, is an oral direct thrombin inhibitor currently in clinical development for the prevention of stroke and systemic embolic events in patients with atrial fibrillation. AZD0837 is bioconve

Catalog Number I003139
CAS Number 433937-93-0
Synonyms

AZD0837; AZD-0837; AZD 0837; Atecegatran metoxil; Atecegatran fexenetil.;(S)-1-((R)-2-(3-chloro-5-(difluoromethoxy)phenyl)-2-hydroxyacetyl)-N-(4-(N-methoxycarbamimidoyl)benzyl)azetidine-2-carboxamide

Molecular Formula

C22H23ClF2N4O5

Purity 95%
Solubility Soluble in DMSO, not in water
Storage 0 - 4 °C for short term or -20 °C for long term
InChI InChI=1S/C22H23ClF2N4O5/c1-33-28-19(26)13-4-2-12(3-5-13)11-27-20(31)17-6-7-29(17)21(32)18(30)14-8-15(23)10-16(9-14)34-22(24)25/h2-5,8-10,17-18,22,30H,6-7,11H2,1H3,(H2,26,28)(H,27,31)/t17-,18+/m0/s1
InChIKey XSNMGLZVFNDDPW-ZWKOTPCHSA-N
SMILES O=C([C@H]1N(C([C@@H](C2=CC(OC(F)F)=CC(Cl)=C2)O)=O)CC1)NCC3=CC=C(C(NOC)=N)C=C3
Reference

</br> 1: Lip GY, Rasmussen LH, Olsson SB, Jensen E, Hamrén B, Eriksson UG, Wåhlander K. Exposure-response for biomarkers of anticoagulant effects by the oral direct thrombin inhibitor AZD0837 in patients with atrial fibrillation. Br J Clin Pharmacol. 2015

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