Y041-6541 Screening compound: tert-butyl 2-({1-[2-(tert-butoxy)-2-oxoethoxy]-6-oxo-6H-benzo[c]chromen-3-yl}oxy)acetate

Y041-6541 Screening compound: tert-butyl 2-({1-[2-(tert-butoxy)-2-oxoethoxy]-6-oxo-6H-benzo[c]chromen-3-yl}oxy)acetate
Y041-6541 Screening compound: tert-butyl 2-({1-[2-(tert-butoxy)-2-oxoethoxy]-6-oxo-6H-benzo[c]chromen-3-yl}oxy)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-6541
tert-butyl 2-({1-[2-(tert-butoxy)-2-oxoethoxy]-6-oxo-6H-benzo[c]chromen-3-yl}oxy)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

Y041-6541

Molecular Formula

C25H28O8 (C25 H28 O8)

Compound Name

tert-butyl 2-({1-[2-(tert-butoxy)-2-oxoethoxy]-6-oxo-6H-benzo[c]chromen-3-yl}oxy)acetate

IUPAC name

tert-butyl 2-({3-[2-(tert-butoxy)-2-oxoethoxy]-6-oxo-6H-benzo[c]chromen-1-yl}oxy)acetate

SMILES

CC(C)(C)OC(COc1cc(OC(c2c-3cccc2)=O)c3c(OCC(OC(C)(C)C)=O)c1)=O

InChI

InChI=1S/C25H28O8/c1-24(2,3)32-20(26)13-29-15-11-18(30-14-21(27)33-25(4,5)6)22-16-9-7-8-10-17(16)23(28)31-19(22)12-15/h7-12H,13-14H2,1-6H3

InChI Key

XNSSMNSNRKKLMQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02331177

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.49

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.163

Distribution Coefficient, logD

4.163

Water Solubility, LogSw

-4.61

Polar Surface Area

74.510

Acid Dissociation Constant (pKa)

26.01

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with Y041-6541 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-6541?
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What is the minimum amount of Y041-6541 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-6541
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-6541
  • 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 Y041-6541 available by request