3771-7573 Screening compound: ethyl 2-{[4,5-bis(acetyloxy)-6-[(acetyloxy)methyl]-3-acetamidooxan-2-yl]oxy}benzoate

3771-7573 Screening compound: ethyl 2-{[4,5-bis(acetyloxy)-6-[(acetyloxy)methyl]-3-acetamidooxan-2-yl]oxy}benzoate
3771-7573 Screening compound: ethyl 2-{[4,5-bis(acetyloxy)-6-[(acetyloxy)methyl]-3-acetamidooxan-2-yl]oxy}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3771-7573
ethyl 2-{[4,5-bis(acetyloxy)-6-[(acetyloxy)methyl]-3-acetamidooxan-2-yl]oxy}benzoate

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

3771-7573

Molecular Formula

C23H29NO11 (C23 H29 NO11)

Compound Name

ethyl 2-{[4,5-bis(acetyloxy)-6-[(acetyloxy)methyl]-3-acetamidooxan-2-yl]oxy}benzoate

IUPAC name

ethyl 2-{[45-bis(acetyloxy)-6-[(acetyloxy)methyl]-3-acetamidooxan-2-yl]oxy}benzoate

SMILES

CCOC(c(cccc1)c1OC(C(C1OC(C)=O)NC(C)=O)OC(COC(C)=O)C1OC(C)=O)=O

InChI

InChI=1S/C23H29NO11/c1-6-30-22(29)16-9-7-8-10-17(16)34-23-19(24-12(2)25)21(33-15(5)28)20(32-14(4)27)18(35-23)11-31-13(3)26/h7-10,18-21,23H,6,11H2,1-5H3,(H,24,25)

InChI Key

GCHAUVQUEGWZJI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02296178

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.48

Hydrogen Bond Acceptors Count

16.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

1.880

Distribution Coefficient, logD

1.880

Water Solubility, LogSw

-2.58

Polar Surface Area

123.723

Acid Dissociation Constant (pKa)

15.13

Base Dissociation Constant (pKb)

-0.93

Number of Chiral Centers

5.00

Percent sp3 carbon bonding

52.20

References: we are preparing a list of scientific research reports with 3771-7573 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3771-7573?
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What is the minimum amount of 3771-7573 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3771-7573
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3771-7573
  • 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 3771-7573 available by request