Chemical Compound

D05CEK

CAS Registry Number100488-87-7
D05CEK chemical structure
Primary record

D05CEK

CAS
100488-87-7
PubChem CID
107757
SMILES
CCCCCCCCCCCCCCCCCCNC(=O)OCC(COC(=O)N(CC1=CC=CC=[N+]1CC)C(=O)C)OC
Molecular Formula
C34H60N3O6+
Molecular Weight
606.869
Exact Mass
606.4477
InChI
InChI=1S/C34H59N3O6/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-25-35-33(39)42-28-32(41-4)29-43-34(40)37(30(3)38)27-31-24-21-23-26-36(31)6-2/h21,23-24,26,32H,5-20,22,25,27-29H2,1-4H3/p+1
InChIKey
LSUANMYXNFBGDT-UHFFFAOYSA-O
LogP
7.4818
TPSA
98.05

Names and synonyms

  • D05CEK
  • CV-6209
  • AC1L32P4
  • CHEMBL274420
  • GTPL1852
  • SCHEMBL8538219
  • CHEMBL1180101
  • CV 6209
  • BDBM50005232
  • CID107757
  • CV6209
  • PDSP1_000727
  • PDSP1_000728
  • PDSP2_000717
  • PDSP2_000718
  • Q27076931
  • 100488-87-7
  • 2-(2-Acetyl-6-methoxy-3,9-dioxo-4,8-dioxa-2,10-diazaoctacosan-1-yl)-1-ethylpyridinium
  • (R)-2-{[Acetyl-(2-methoxy-3-octadecylcarbamoyloxy-propoxycarbonyl)-amino]-methyl}-1-ethyl-pyridinium; chloride
  • (S)-2-{[Acetyl-(2-methoxy-3-octadecylcarbamoyloxy-propoxycarbonyl)-amino]-methyl}-1-ethyl-pyridinium; chloride
  • [2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate
  • [3-[acetyl-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamoyl]oxy-2-methoxypropyl] N-octadecylcarbamate
  • [3-[acetyl-[(1-ethylpyridin-6-yl)methyl]carbamoyl]oxy-2-methoxy-propyl] N-octadecylcarbamate
  • 1-ethyl-2-{[N-({2-methoxy-3-[(octadecylcarbamoyl)oxy]propoxy}carbonyl)acetamido]methyl}pyridin-1-ium
  • 2-{[Acetyl-(2-methoxy-3-octadecylcarbamoyloxy-propoxycarbonyl)-amino]-methyl}-1-ethyl-pyridinium; chloride
  • 2-{[Acetyl-(2-methoxy-3-octadecylcarbamoyloxy-propoxycarbonyl)-amino]-methyl}-1-ethyl-pyridinium; iodide