Y070-1507 Screening compound: 4-{[(5E)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-oxo-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-ylidene]methyl}-2-ethoxyphenyl acetate

Y070-1507 Screening compound: 4-{[(5E)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-oxo-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-ylidene]methyl}-2-ethoxyphenyl acetate
Y070-1507 Screening compound: 4-{[(5E)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-oxo-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-ylidene]methyl}-2-ethoxyphenyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-1507
4-{[(5E)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-oxo-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-ylidene]methyl}-2-ethoxyphenyl 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

Y070-1507

Molecular Formula

C23H19N3O6S (C23 H19 N3 O6 S)

Compound Name

4-{[(5E)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-oxo-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-ylidene]methyl}-2-ethoxyphenyl acetate

IUPAC name

4-{[(5E)-2-(23-dihydro-14-benzodioxin-2-yl)-6-oxo-5H6H-[124]triazolo[32-b][13]thiazol-5-ylidene]methyl}-2-ethoxyphenyl acetate

SMILES

CCOc(cc(/C=C1/Sc2nc(C3Oc(cccc4)c4OC3)nn2C1=O)cc1)c1OC(C)=O

InChI

InChI=1S/C23H19N3O6S/c1-3-29-18-10-14(8-9-17(18)31-13(2)27)11-20-22(28)26-23(33-20)24-21(25-26)19-12-30-15-6-4-5-7-16(15)32-19/h4-11,19H,3,12H2,1-2H3/t19-/m0/s1

InChI Key

HCIWAXUVLPWTTN-IBGZPJMESA-N

MDL Number (MFCD)

MFCD18075678

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.49

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.368

Distribution Coefficient, logD

3.368

Water Solubility, LogSw

-3.72

Polar Surface Area

80.681

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

-3.24

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.70

References: we are preparing a list of scientific research reports with Y070-1507 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of Y070-1507 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-1507
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-1507
  • 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 Y070-1507 available by request