Y070-0943 Screening compound: (2Z)-2-(1,3-benzoxazol-2-yl)-3-(3,4-dimethoxyphenyl)-1-(4-ethoxyphenyl)prop-2-en-1-one

Y070-0943 Screening compound: (2Z)-2-(1,3-benzoxazol-2-yl)-3-(3,4-dimethoxyphenyl)-1-(4-ethoxyphenyl)prop-2-en-1-one
Y070-0943 Screening compound: (2Z)-2-(1,3-benzoxazol-2-yl)-3-(3,4-dimethoxyphenyl)-1-(4-ethoxyphenyl)prop-2-en-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-0943
(2Z)-2-(1,3-benzoxazol-2-yl)-3-(3,4-dimethoxyphenyl)-1-(4-ethoxyphenyl)prop-2-en-1-one

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

Y070-0943

Molecular Formula

C26H23NO5 (C26 H23 NO5)

Compound Name

(2Z)-2-(1,3-benzoxazol-2-yl)-3-(3,4-dimethoxyphenyl)-1-(4-ethoxyphenyl)prop-2-en-1-one

IUPAC name

(2Z)-2-(13-benzoxazol-2-yl)-3-(34-dimethoxyphenyl)-1-(4-ethoxyphenyl)prop-2-en-1-one

SMILES

CCOc(cc1)ccc1C(/C(/c1nc(cccc2)c2o1)=C\c(cc1)cc(OC)c1OC)=O

InChI

InChI=1S/C26H23NO5/c1-4-31-19-12-10-18(11-13-19)25(28)20(26-27-21-7-5-6-8-22(21)32-26)15-17-9-14-23(29-2)24(16-17)30-3/h5-16H,4H2,1-3H3

InChI Key

ZSBOCSJLGCTJOY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03212443

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.532

Distribution Coefficient, logD

5.532

Water Solubility, LogSw

-5.55

Polar Surface Area

52.900

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

-7.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

Y070-0943 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y070-0943 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-0943?
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What is the minimum amount of Y070-0943 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-0943
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-0943
  • 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 Y070-0943 available by request