4373-3494 Screening compound: (acetyloxy){4-[4-(acetyloxy)phenyl]-3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-1-yl}methyl acetate

4373-3494 Screening compound: (acetyloxy){4-[4-(acetyloxy)phenyl]-3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-1-yl}methyl acetate
4373-3494 Screening compound: (acetyloxy){4-[4-(acetyloxy)phenyl]-3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-1-yl}methyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4373-3494
(acetyloxy){4-[4-(acetyloxy)phenyl]-3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-1-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

4373-3494

Molecular Formula

C21H19NO9 (C21 H19 NO9)

Compound Name

(acetyloxy){4-[4-(acetyloxy)phenyl]-3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-1-yl}methyl acetate

IUPAC name

(acetyloxy)({4-[4-(acetyloxy)phenyl]-35-dioxo-10-oxa-4-azatricyclo[5.2.1.0^{26}]dec-8-en-1-yl})methyl acetate

SMILES

CC(OC(C1(C(C2C(N3c(cc4)ccc4OC(C)=O)=O)C3=O)OC2C=C1)OC(C)=O)=O

InChI

InChI=1S/C21H19NO9/c1-10(23)28-14-6-4-13(5-7-14)22-18(26)16-15-8-9-21(31-15,17(16)19(22)27)20(29-11(2)24)30-12(3)25/h4-9,15-17,20H,1-3H3

InChI Key

QNSWCCCHTNXZTQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03159011

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.38

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.204

Distribution Coefficient, logD

0.204

Water Solubility, LogSw

-1.34

Polar Surface Area

99.620

Acid Dissociation Constant (pKa)

16.72

Base Dissociation Constant (pKb)

-4.83

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

38.10

4373-3494 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system

References: we are preparing a list of scientific research reports with 4373-3494 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4373-3494?
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What is the minimum amount of 4373-3494 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4373-3494
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4373-3494
  • 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 4373-3494 available by request