D349-2273 Screening compound: 2-nitro-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-(2-phenylethyl)aniline

D349-2273 Screening compound: 2-nitro-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-(2-phenylethyl)aniline
D349-2273 Screening compound: 2-nitro-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-(2-phenylethyl)aniline alternative view

Chemical Structure Depiction of ChemDiv screening compound D349-2273
2-nitro-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-(2-phenylethyl)aniline

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

D349-2273

Molecular Formula

C22H18N4O3 (C22 H18 N4 O3)

Compound Name

2-nitro-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-(2-phenylethyl)aniline

IUPAC name

2-nitro-4-(3-phenyl-124-oxadiazol-5-yl)-N-(2-phenylethyl)aniline

SMILES

[O-][N+](c(cc(cc1)-c2nc(-c3ccccc3)no2)c1NCCc1ccccc1)=O

InChI

InChI=1S/C22H18N4O3/c27-26(28)20-15-18(22-24-21(25-29-22)17-9-5-2-6-10-17)11-12-19(20)23-14-13-16-7-3-1-4-8-16/h1-12,15,23H,13-14H2

InChI Key

MAUNRNTUJCHIFC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14821322

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.441

Distribution Coefficient, logD

5.441

Water Solubility, LogSw

-5.89

Polar Surface Area

74.103

Acid Dissociation Constant (pKa)

17.92

Base Dissociation Constant (pKb)

-1.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

D349-2273 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D349-2273 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D349-2273?
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What is the minimum amount of D349-2273 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D349-2273
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D349-2273
  • 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 D349-2273 available by request