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Chemical structure of Dabigatran etexilate-d13

GC47165

Dabigatran etexilate-d13

Also known as ethyl 3-[[1-methyl-2-[[4-[N-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecadeuteriohexoxycarbonyl)carbamimidoyl]anilino]methyl]benzimidazole-5-carbonyl]-pyridin-2-ylamino]propanoate

A neuropeptide with diverse biological activities

ChemicalCAS2749293-92-1MW640.8FormulaC34H28D13N7O5
CAS number
2749293-92-1
Molecular weight
640.8
Formula
C34H28D13N7O5
Solubility
DMSO： 0·5 mg/ml @ 25 degrees C
InChIKey
KSGXQBZTULBEEQ-BTQQZDERSA-N
Catalogue number
GC47165
Brand
GLPBIO
Computed properties PubChem CID 137699849 · XLogP 5.3 · TPSA 152 Ų · H-bond donors 3
XLogP
5.3
TPSA
152 Ų
H-bond donors
3
H-bond acceptors
9
Rotatable bonds
18
Heavy atoms
46

SMILES [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])OC(=O)NC(=N)C1=CC=C(C=C1)NCC2=NC3=C(N2C)C=CC(=C3)C(=O)N(CCC(=O)OCC)C4=CC=CC=N4

Computed descriptors from PubChem (CID 137699849), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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