Y070-4494 Screening compound: 1-[2-(diethylamino)ethyl]-5-(2,3-dimethoxyphenyl)-3-hydroxy-4-[4-(propan-2-yloxy)benzoyl]-2,5-dihydro-1H-pyrrol-2-one

Y070-4494 Screening compound: 1-[2-(diethylamino)ethyl]-5-(2,3-dimethoxyphenyl)-3-hydroxy-4-[4-(propan-2-yloxy)benzoyl]-2,5-dihydro-1H-pyrrol-2-one
Y070-4494 Screening compound: 1-[2-(diethylamino)ethyl]-5-(2,3-dimethoxyphenyl)-3-hydroxy-4-[4-(propan-2-yloxy)benzoyl]-2,5-dihydro-1H-pyrrol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-4494
1-[2-(diethylamino)ethyl]-5-(2,3-dimethoxyphenyl)-3-hydroxy-4-[4-(propan-2-yloxy)benzoyl]-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

Y070-4494

Molecular Formula

C28H36N2O6 (C28 H36 N2 O6)

Compound Name

1-[2-(diethylamino)ethyl]-5-(2,3-dimethoxyphenyl)-3-hydroxy-4-[4-(propan-2-yloxy)benzoyl]-2,5-dihydro-1H-pyrrol-2-one

IUPAC name

1-[2-(diethylamino)ethyl]-5-(23-dimethoxyphenyl)-3-hydroxy-4-[4-(propan-2-yloxy)benzoyl]-25-dihydro-1H-pyrrol-2-one

SMILES

CCN(CC)CCN(C(C(C(c(cc1)ccc1OC(C)C)=O)=C1O)c(cccc2OC)c2OC)C1=O

InChI

InChI=1S/C28H36N2O6/c1-7-29(8-2)16-17-30-24(21-10-9-11-22(34-5)27(21)35-6)23(26(32)28(30)33)25(31)19-12-14-20(15-13-19)36-18(3)4/h9-15,18,24,32H,7-8,16-17H2,1-6H3/t24-/m0/s1

InChI Key

LIUDSUBMKQJCEA-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD04178115

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.6

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.988

Distribution Coefficient, logD

2.882

Water Solubility, LogSw

-4.05

Polar Surface Area

70.638

Acid Dissociation Constant (pKa)

9.97

Base Dissociation Constant (pKb)

8.47

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.90

Y070-4494 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 Y070-4494 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-4494?
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What is the minimum amount of Y070-4494 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-4494
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-4494
  • 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 Y070-4494 available by request