D682-0002 Screening compound: 1-(2-bromobenzoyl)-4-{[1,3]oxazolo[4,5-b]pyridin-2-yl}piperazine

D682-0002 Screening compound: 1-(2-bromobenzoyl)-4-{[1,3]oxazolo[4,5-b]pyridin-2-yl}piperazine
D682-0002 Screening compound: 1-(2-bromobenzoyl)-4-{[1,3]oxazolo[4,5-b]pyridin-2-yl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D682-0002
1-(2-bromobenzoyl)-4-{[1,3]oxazolo[4,5-b]pyridin-2-yl}piperazine

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

D682-0002

Molecular Formula

C17H15BrN4O2 (C17 H15 BrN4 O2)

Compound Name

1-(2-bromobenzoyl)-4-{[1,3]oxazolo[4,5-b]pyridin-2-yl}piperazine

IUPAC name

1-(2-bromobenzoyl)-4-{[13]oxazolo[45-b]pyridin-2-yl}piperazine

SMILES

O=C(c(cccc1)c1Br)N(CC1)CCN1c1nc(nccc2)c2o1

InChI

InChI=1S/C17H15BrN4O2/c18-13-5-2-1-4-12(13)16(23)21-8-10-22(11-9-21)17-20-15-14(24-17)6-3-7-19-15/h1-7H,8-11H2

InChI Key

YXGCDUQKIYHFFM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596403

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.24

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.457

Distribution Coefficient, logD

2.457

Water Solubility, LogSw

-2.73

Polar Surface Area

47.674

Acid Dissociation Constant (pKa)

22.96

Base Dissociation Constant (pKb)

2.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

D682-0002 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D682-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D682-0002?
Check Price and Availability of D682-0002, 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 D682-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D682-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D682-0002
  • 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 D682-0002 available by request