D349-3340 Screening compound: N-cyclopentyl-2-nitro-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]aniline

D349-3340 Screening compound: N-cyclopentyl-2-nitro-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]aniline
D349-3340 Screening compound: N-cyclopentyl-2-nitro-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]aniline alternative view

Chemical Structure Depiction of ChemDiv screening compound D349-3340
N-cyclopentyl-2-nitro-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]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

D349-3340

Molecular Formula

C18H17N5O3 (C18 H17 N5 O3)

Compound Name

N-cyclopentyl-2-nitro-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]aniline

IUPAC name

N-cyclopentyl-2-nitro-4-[3-(pyridin-4-yl)-124-oxadiazol-5-yl]aniline

SMILES

[O-][N+](c(cc(cc1)-c2nc(-c3ccncc3)no2)c1NC1CCCC1)=O

InChI

InChI=1S/C18H17N5O3/c24-23(25)16-11-13(5-6-15(16)20-14-3-1-2-4-14)18-21-17(22-26-18)12-7-9-19-10-8-12/h5-11,14,20H,1-4H2

InChI Key

YITWJRKBRGRGTI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14821659

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.36

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.184

Distribution Coefficient, logD

4.184

Water Solubility, LogSw

-4.34

Polar Surface Area

83.781

Acid Dissociation Constant (pKa)

19.68

Base Dissociation Constant (pKb)

3.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

References: we are preparing a list of scientific research reports with D349-3340 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D349-3340?
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What is the minimum amount of D349-3340 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D349-3340
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D349-3340
  • 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 D349-3340 available by request