G349-0086 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-phenyl-1,2,4-oxadiazol-5-amine

G349-0086 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-phenyl-1,2,4-oxadiazol-5-amine
G349-0086 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-phenyl-1,2,4-oxadiazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound G349-0086
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-phenyl-1,2,4-oxadiazol-5-amine

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

G349-0086

Molecular Formula

C16H13N3O3 (C16 H13 N3 O3)

Compound Name

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-phenyl-1,2,4-oxadiazol-5-amine

IUPAC name

N-(23-dihydro-14-benzodioxin-6-yl)-3-phenyl-124-oxadiazol-5-amine

SMILES

C1Oc(ccc(Nc2nc(-c3ccccc3)no2)c2)c2OC1

InChI

InChI=1S/C16H13N3O3/c1-2-4-11(5-3-1)15-18-16(22-19-15)17-12-6-7-13-14(10-12)21-9-8-20-13/h1-7,10H,8-9H2,(H,17,18,19)

InChI Key

ZELLJWXALWMYQL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27136769

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

295.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.030

Distribution Coefficient, logD

3.030

Water Solubility, LogSw

-3.35

Polar Surface Area

57.964

Acid Dissociation Constant (pKa)

17.68

Base Dissociation Constant (pKb)

-0.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

G349-0086 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G349-0086 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G349-0086?
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What is the minimum amount of G349-0086 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G349-0086
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G349-0086
  • 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 G349-0086 available by request