Y070-5028 Screening compound: 5-(3,4-diethoxyphenyl)-1-[2-(dimethylamino)ethyl]-3-hydroxy-4-(2-methyl-2,3-dihydro-1-benzofuran-5-carbonyl)-2,5-dihydro-1H-pyrrol-2-one

Y070-5028 Screening compound: 5-(3,4-diethoxyphenyl)-1-[2-(dimethylamino)ethyl]-3-hydroxy-4-(2-methyl-2,3-dihydro-1-benzofuran-5-carbonyl)-2,5-dihydro-1H-pyrrol-2-one
Y070-5028 Screening compound: 5-(3,4-diethoxyphenyl)-1-[2-(dimethylamino)ethyl]-3-hydroxy-4-(2-methyl-2,3-dihydro-1-benzofuran-5-carbonyl)-2,5-dihydro-1H-pyrrol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-5028
5-(3,4-diethoxyphenyl)-1-[2-(dimethylamino)ethyl]-3-hydroxy-4-(2-methyl-2,3-dihydro-1-benzofuran-5-carbonyl)-2,5-dihydro-1H-pyrrol-2-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

Y070-5028

Molecular Formula

C28H34N2O6 (C28 H34 N2 O6)

Compound Name

5-(3,4-diethoxyphenyl)-1-[2-(dimethylamino)ethyl]-3-hydroxy-4-(2-methyl-2,3-dihydro-1-benzofuran-5-carbonyl)-2,5-dihydro-1H-pyrrol-2-one

IUPAC name

5-(34-diethoxyphenyl)-1-[2-(dimethylamino)ethyl]-3-hydroxy-4-(2-methyl-23-dihydro-1-benzofuran-5-carbonyl)-25-dihydro-1H-pyrrol-2-one

SMILES

CCOc(ccc(C(C(C(c(cc1)cc2c1OC(C)C2)=O)=C1O)N(CCN(C)C)C1=O)c1)c1OCC

InChI

InChI=1S/C28H34N2O6/c1-6-34-22-11-8-18(16-23(22)35-7-2)25-24(27(32)28(33)30(25)13-12-29(4)5)26(31)19-9-10-21-20(15-19)14-17(3)36-21/h8-11,15-17,25,32H,6-7,12-14H2,1-5H3

InChI Key

OUSIXWOHBKBUPI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06603428

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.59

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.327

Distribution Coefficient, logD

2.494

Water Solubility, LogSw

-3.21

Polar Surface Area

70.765

Acid Dissociation Constant (pKa)

9.97

Base Dissociation Constant (pKb)

8.16

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

42.90

Y070-5028 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with Y070-5028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-5028?
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What is the minimum amount of Y070-5028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-5028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-5028
  • 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 Y070-5028 available by request