8015-0125 Screening compound: 3-(3,4-dimethoxyphenyl)-3-{2-[2-(propan-2-yl)phenoxy]acetamido}propanoic acid

8015-0125 Screening compound: 3-(3,4-dimethoxyphenyl)-3-{2-[2-(propan-2-yl)phenoxy]acetamido}propanoic acid
8015-0125 Screening compound: 3-(3,4-dimethoxyphenyl)-3-{2-[2-(propan-2-yl)phenoxy]acetamido}propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-0125
3-(3,4-dimethoxyphenyl)-3-{2-[2-(propan-2-yl)phenoxy]acetamido}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

8015-0125

Molecular Formula

C22H27NO6 (C22 H27 NO6)

Compound Name

3-(3,4-dimethoxyphenyl)-3-{2-[2-(propan-2-yl)phenoxy]acetamido}propanoic acid

IUPAC name

3-(34-dimethoxyphenyl)-3-{2-[2-(propan-2-yl)phenoxy]acetamido}propanoic acid

SMILES

CC(C)c(cccc1)c1OCC(NC(CC(O)=O)c(cc1)cc(OC)c1OC)=O

InChI

InChI=1S/C22H27NO6/c1-14(2)16-7-5-6-8-18(16)29-13-21(24)23-17(12-22(25)26)15-9-10-19(27-3)20(11-15)28-4/h5-11,14,17H,12-13H2,1-4H3,(H,23,24)(H,25,26)/t17-/m0/s1

InChI Key

FFUJSBLQNDHRCM-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD03821665

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.179

Distribution Coefficient, logD

0.541

Water Solubility, LogSw

-3.26

Polar Surface Area

75.299

Acid Dissociation Constant (pKa)

4.76

Base Dissociation Constant (pKb)

-1.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with 8015-0125 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-0125?
Check Price and Availability of 8015-0125, 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 8015-0125 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-0125
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-0125
  • 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 8015-0125 available by request