D135-0142 Screening compound: 3-(1-{[(4-ethoxyphenyl)carbamoyl]methyl}-5-(4-methoxyphenyl)-1H-pyrrol-2-yl)propanoic acid

D135-0142 Screening compound: 3-(1-{[(4-ethoxyphenyl)carbamoyl]methyl}-5-(4-methoxyphenyl)-1H-pyrrol-2-yl)propanoic acid
D135-0142 Screening compound: 3-(1-{[(4-ethoxyphenyl)carbamoyl]methyl}-5-(4-methoxyphenyl)-1H-pyrrol-2-yl)propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound D135-0142
3-(1-{[(4-ethoxyphenyl)carbamoyl]methyl}-5-(4-methoxyphenyl)-1H-pyrrol-2-yl)propanoic 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

D135-0142

Molecular Formula

C24H26N2O5 (C24 H26 N2 O5)

Compound Name

3-(1-{[(4-ethoxyphenyl)carbamoyl]methyl}-5-(4-methoxyphenyl)-1H-pyrrol-2-yl)propanoic acid

IUPAC name

3-(1-{[(4-ethoxyphenyl)carbamoyl]methyl}-5-(4-methoxyphenyl)-1H-pyrrol-2-yl)propanoic acid

SMILES

CCOc(cc1)ccc1NC(Cn1c(-c(cc2)ccc2OC)ccc1CCC(O)=O)=O

InChI

InChI=1S/C24H26N2O5/c1-3-31-21-12-6-18(7-13-21)25-23(27)16-26-19(9-15-24(28)29)8-14-22(26)17-4-10-20(30-2)11-5-17/h4-8,10-14H,3,9,15-16H2,1-2H3,(H,25,27)(H,28,29)

InChI Key

GTKVXCUULXIAHI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05846967

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.409

Distribution Coefficient, logD

1.596

Water Solubility, LogSw

-4.07

Polar Surface Area

66.853

Acid Dissociation Constant (pKa)

4.59

Base Dissociation Constant (pKb)

2.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

D135-0142 in Drug Discovery

Included in Screening Libraries

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D135-0142 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D135-0142?
Check Price and Availability of D135-0142, 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 D135-0142 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D135-0142
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D135-0142
  • 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 D135-0142 available by request