G856-7571 Screening compound: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidin-3-yl]-2H-1,3-benzodioxole-5-carboxamide

G856-7571 Screening compound: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidin-3-yl]-2H-1,3-benzodioxole-5-carboxamide
G856-7571 Screening compound: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidin-3-yl]-2H-1,3-benzodioxole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G856-7571
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidin-3-yl]-2H-1,3-benzodioxole-5-carboxamide

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

G856-7571

Molecular Formula

C20H18N2O6 (C20 H18 N2 O6)

Compound Name

N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidin-3-yl]-2H-1,3-benzodioxole-5-carboxamide

IUPAC name

N-[1-(23-dihydro-14-benzodioxin-6-yl)-5-oxopyrrolidin-3-yl]-2H-13-benzodioxole-5-carboxamide

SMILES

O=C(c(cc1)cc2c1OCO2)NC(CC1=O)CN1c(cc1)cc2c1OCCO2

InChI

InChI=1S/C20H18N2O6/c23-19-8-13(21-20(24)12-1-3-16-17(7-12)28-11-27-16)10-22(19)14-2-4-15-18(9-14)26-6-5-25-15/h1-4,7,9,13H,5-6,8,10-11H2,(H,21,24)/t13-/m1/s1

InChI Key

WQOGLIFBAGBBHE-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD06731187

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.37

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.269

Distribution Coefficient, logD

1.269

Water Solubility, LogSw

-2.14

Polar Surface Area

73.873

Acid Dissociation Constant (pKa)

14.34

Base Dissociation Constant (pKb)

-3.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

G856-7571 in Drug Discovery

Included in Screening Libraries

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

CNS MPO Library (28609 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G856-7571 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-7571?
Check Price and Availability of G856-7571, 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 G856-7571 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-7571
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-7571
  • 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 G856-7571 available by request