Y041-1815 Screening compound: ethyl 3-{4,8-dimethyl-2-oxo-7-[(2,3,4,5,6-pentamethylphenyl)methoxy]-2H-chromen-3-yl}propanoate

Y041-1815 Screening compound: ethyl 3-{4,8-dimethyl-2-oxo-7-[(2,3,4,5,6-pentamethylphenyl)methoxy]-2H-chromen-3-yl}propanoate
Y041-1815 Screening compound: ethyl 3-{4,8-dimethyl-2-oxo-7-[(2,3,4,5,6-pentamethylphenyl)methoxy]-2H-chromen-3-yl}propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-1815
ethyl 3-{4,8-dimethyl-2-oxo-7-[(2,3,4,5,6-pentamethylphenyl)methoxy]-2H-chromen-3-yl}propanoate

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

Y041-1815

Molecular Formula

C28H34O5 (C28 H34 O5)

Compound Name

ethyl 3-{4,8-dimethyl-2-oxo-7-[(2,3,4,5,6-pentamethylphenyl)methoxy]-2H-chromen-3-yl}propanoate

IUPAC name

ethyl 3-{48-dimethyl-2-oxo-7-[(23456-pentamethylphenyl)methoxy]-2H-chromen-3-yl}propanoate

SMILES

CCOC(CCC1=C(C)c(ccc(OCc2c(C)c(C)c(C)c(C)c2C)c2C)c2OC1=O)=O

InChI

InChI=1S/C28H34O5/c1-9-31-26(29)13-11-23-20(7)22-10-12-25(21(8)27(22)33-28(23)30)32-14-24-18(5)16(3)15(2)17(4)19(24)6/h10,12H,9,11,13-14H2,1-8H3

InChI Key

WOAXFDUUAHOWJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03854023

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.364

Distribution Coefficient, logD

7.364

Water Solubility, LogSw

-5.85

Polar Surface Area

48.317

Acid Dissociation Constant (pKa)

23.48

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with Y041-1815 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-1815?
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What is the minimum amount of Y041-1815 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-1815
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-1815
  • 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 Y041-1815 available by request