1261-0034 Screening compound: [3,4-bis(acetyloxy)-6-[(2-dodecyltetradecyl)oxy]-5-acetamidooxan-2-yl]methyl acetate

1261-0034 Screening compound: [3,4-bis(acetyloxy)-6-[(2-dodecyltetradecyl)oxy]-5-acetamidooxan-2-yl]methyl acetate
1261-0034 Screening compound: [3,4-bis(acetyloxy)-6-[(2-dodecyltetradecyl)oxy]-5-acetamidooxan-2-yl]methyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1261-0034
[3,4-bis(acetyloxy)-6-[(2-dodecyltetradecyl)oxy]-5-acetamidooxan-2-yl]methyl acetate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

1261-0034

Molecular Formula

C40H73NO9 (C40 H73 NO9)

Compound Name

[3,4-bis(acetyloxy)-6-[(2-dodecyltetradecyl)oxy]-5-acetamidooxan-2-yl]methyl acetate

IUPAC name

[34-bis(acetyloxy)-6-[(2-dodecyltetradecyl)oxy]-5-acetamidooxan-2-yl]methyl acetate

SMILES

CCCCCCCCCCCCC(CCCCCCCCCCCC)COC(C(C1OC(C)=O)NC(C)=O)OC(COC(C)=O)C1OC(C)=O

InChI

InChI=1S/C40H73NO9/c1-7-9-11-13-15-17-19-21-23-25-27-35(28-26-24-22-20-18-16-14-12-10-8-2)29-47-40-37(41-31(3)42)39(49-34(6)45)38(48-33(5)44)36(50-40)30-46-32(4)43/h35-40H,7-30H2,1-6H3,(H,41,42)

InChI Key

QVWUTEYXUYBGKO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01118811

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

712.02

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

34.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

12.129

Distribution Coefficient, logD

12.129

Water Solubility, LogSw

-5.88

Polar Surface Area

103.634

Acid Dissociation Constant (pKa)

14.87

Base Dissociation Constant (pKb)

-0.97

Number of Chiral Centers

5.00

Percent sp3 carbon bonding

90.00

References: we are preparing a list of scientific research reports with 1261-0034 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1261-0034?
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What is the minimum amount of 1261-0034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1261-0034
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1261-0034
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 1261-0034 available by request