2036-1685 Screening compound: N-(4-{3-[4-(2,2-dimethylpropanamido)phenoxy]phenoxy}phenyl)-2,2-dimethylpropanamide

2036-1685 Screening compound: N-(4-{3-[4-(2,2-dimethylpropanamido)phenoxy]phenoxy}phenyl)-2,2-dimethylpropanamide
2036-1685 Screening compound: N-(4-{3-[4-(2,2-dimethylpropanamido)phenoxy]phenoxy}phenyl)-2,2-dimethylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2036-1685
N-(4-{3-[4-(2,2-dimethylpropanamido)phenoxy]phenoxy}phenyl)-2,2-dimethylpropanamide

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

2036-1685

Molecular Formula

C28H32N2O4 (C28 H32 N2 O4)

Compound Name

N-(4-{3-[4-(2,2-dimethylpropanamido)phenoxy]phenoxy}phenyl)-2,2-dimethylpropanamide

IUPAC name

N-(4-{3-[4-(22-dimethylpropanamido)phenoxy]phenoxy}phenyl)-22-dimethylpropanamide

SMILES

CC(C)(C)C(Nc(cc1)ccc1Oc1cccc(Oc(cc2)ccc2NC(C(C)(C)C)=O)c1)=O

InChI

InChI=1S/C28H32N2O4/c1-27(2,3)25(31)29-19-10-14-21(15-11-19)33-23-8-7-9-24(18-23)34-22-16-12-20(13-17-22)30-26(32)28(4,5)6/h7-18H,1-6H3,(H,29,31)(H,30,32)

InChI Key

CAYSFNNPRQIGBY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00315645

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.365

Distribution Coefficient, logD

6.365

Water Solubility, LogSw

-5.61

Polar Surface Area

60.459

Acid Dissociation Constant (pKa)

12.07

Base Dissociation Constant (pKb)

1.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

2036-1685 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with 2036-1685 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2036-1685?
Check Price and Availability of 2036-1685, 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 2036-1685 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2036-1685
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2036-1685
  • 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 2036-1685 available by request