D320-0185 Screening compound: N-(3-nitrophenyl)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]propanamide

D320-0185 Screening compound: N-(3-nitrophenyl)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]propanamide
D320-0185 Screening compound: N-(3-nitrophenyl)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D320-0185
N-(3-nitrophenyl)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-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

D320-0185

Molecular Formula

C16H13N5O4 (C16 H13 N5 O4)

Compound Name

N-(3-nitrophenyl)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]propanamide

IUPAC name

N-(3-nitrophenyl)-3-[3-(pyridin-4-yl)-124-oxadiazol-5-yl]propanamide

SMILES

[O-][N+](c1cc(NC(CCc2nc(-c3ccncc3)no2)=O)ccc1)=O

InChI

InChI=1S/C16H13N5O4/c22-14(18-12-2-1-3-13(10-12)21(23)24)4-5-15-19-16(20-25-15)11-6-8-17-9-7-11/h1-3,6-10H,4-5H2,(H,18,22)

InChI Key

SLDOFLGWQWAADO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08111499

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.31

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.522

Distribution Coefficient, logD

2.521

Water Solubility, LogSw

-2.68

Polar Surface Area

97.269

Acid Dissociation Constant (pKa)

9.90

Base Dissociation Constant (pKb)

3.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

D320-0185 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 D320-0185 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D320-0185?
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What is the minimum amount of D320-0185 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D320-0185
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D320-0185
  • 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 D320-0185 available by request