4884-9063 Screening compound: 4-[2-(2,5-dimethoxyphenyl)-4-hydroxy-3-(4-methoxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoic acid

4884-9063 Screening compound: 4-[2-(2,5-dimethoxyphenyl)-4-hydroxy-3-(4-methoxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoic acid
4884-9063 Screening compound: 4-[2-(2,5-dimethoxyphenyl)-4-hydroxy-3-(4-methoxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 4884-9063
4-[2-(2,5-dimethoxyphenyl)-4-hydroxy-3-(4-methoxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoic acid

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

4884-9063

Molecular Formula

C24H25NO8 (C24 H25 NO8)

Compound Name

4-[2-(2,5-dimethoxyphenyl)-4-hydroxy-3-(4-methoxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoic acid

IUPAC name

4-[2-(25-dimethoxyphenyl)-4-hydroxy-3-(4-methoxybenzoyl)-5-oxo-25-dihydro-1H-pyrrol-1-yl]butanoic acid

SMILES

COc(cc1)ccc1C(C(C(c(cc(cc1)OC)c1OC)N(CCCC(O)=O)C1=O)=C1O)=O

InChI

InChI=1S/C24H25NO8/c1-31-15-8-6-14(7-9-15)22(28)20-21(17-13-16(32-2)10-11-18(17)33-3)25(24(30)23(20)29)12-4-5-19(26)27/h6-11,13,21,29H,4-5,12H2,1-3H3,(H,26,27)/t21-/m0/s1

InChI Key

HRVVTJVDJNXLKD-NRFANRHFSA-N

MDL Number (MFCD)

MFCD14710244

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.46

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.036

Distribution Coefficient, logD

-0.784

Water Solubility, LogSw

-2.64

Polar Surface Area

96.179

Acid Dissociation Constant (pKa)

4.58

Base Dissociation Constant (pKb)

-4.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.20

4884-9063 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4884-9063 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4884-9063?
Check Price and Availability of 4884-9063, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 4884-9063 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4884-9063
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4884-9063
  • 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 4884-9063 available by request