D269-1055 Screening compound: 2-(4-fluorophenoxy)-N-{4-[4-(2-methylpropoxy)phenyl]-1,2,5-oxadiazol-3-yl}propanamide

D269-1055 Screening compound: 2-(4-fluorophenoxy)-N-{4-[4-(2-methylpropoxy)phenyl]-1,2,5-oxadiazol-3-yl}propanamide
D269-1055 Screening compound: 2-(4-fluorophenoxy)-N-{4-[4-(2-methylpropoxy)phenyl]-1,2,5-oxadiazol-3-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D269-1055
2-(4-fluorophenoxy)-N-{4-[4-(2-methylpropoxy)phenyl]-1,2,5-oxadiazol-3-yl}propanamide

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

D269-1055

Molecular Formula

C21H22FN3O4 (C21 H22 FN3 O4)

Compound Name

2-(4-fluorophenoxy)-N-{4-[4-(2-methylpropoxy)phenyl]-1,2,5-oxadiazol-3-yl}propanamide

IUPAC name

2-(4-fluorophenoxy)-N-{4-[4-(2-methylpropoxy)phenyl]-125-oxadiazol-3-yl}propanamide

SMILES

CC(C)COc(cc1)ccc1-c1nonc1NC(C(C)Oc(cc1)ccc1F)=O

InChI

InChI=1S/C21H22FN3O4/c1-13(2)12-27-17-8-4-15(5-9-17)19-20(25-29-24-19)23-21(26)14(3)28-18-10-6-16(22)7-11-18/h4-11,13-14H,12H2,1-3H3,(H,23,25,26)/t14-/m0/s1

InChI Key

OLSSEDAVYHMNDF-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD08544821

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.269

Distribution Coefficient, logD

5.262

Water Solubility, LogSw

-5.23

Polar Surface Area

74.374

Acid Dissociation Constant (pKa)

9.22

Base Dissociation Constant (pKb)

-4.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

D269-1055 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D269-1055 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D269-1055?
Check Price and Availability of D269-1055, 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 D269-1055 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D269-1055
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D269-1055
  • 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 D269-1055 available by request