SB56-1015 Screening compound: 2-pyrazinyl{(3R,4S)-3-(3-pyridyl)-4-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]tetrahydro-1H-pyrrol-1-yl}methanone

SB56-1015 Screening compound: 2-pyrazinyl{(3R,4S)-3-(3-pyridyl)-4-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]tetrahydro-1H-pyrrol-1-yl}methanone
SB56-1015 Screening compound: 2-pyrazinyl{(3R,4S)-3-(3-pyridyl)-4-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]tetrahydro-1H-pyrrol-1-yl}methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SB56-1015
2-pyrazinyl{(3R,4S)-3-(3-pyridyl)-4-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]tetrahydro-1H-pyrrol-1-yl}methanone

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

SB56-1015

Molecular Formula

C21H17N7O2 (C21 H17 N7 O2)

Compound Name

2-pyrazinyl{(3R,4S)-3-(3-pyridyl)-4-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]tetrahydro-1H-pyrrol-1-yl}methanone

IUPAC name

2-[(3R4S)-3-(pyridin-3-yl)-4-[3-(pyridin-4-yl)-124-oxadiazol-5-yl]pyrrolidine-1-carbonyl]pyrazine

SMILES

O=C(c1nccnc1)N(C[C@@H]1c2nc(-c3ccncc3)no2)C[C@@H]1c1cnccc1

InChI

InChI=1S/C21H17N7O2/c29-21(18-11-24-8-9-25-18)28-12-16(15-2-1-5-23-10-15)17(13-28)20-26-19(27-30-20)14-3-6-22-7-4-14/h1-11,16-17H,12-13H2/t16-,17+/m0/s1

InChI Key

ZIVVXYRJNHOSFZ-DLBZAZTESA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.410

Distribution Coefficient, logD

1.408

Water Solubility, LogSw

-1.54

Polar Surface Area

85.766

Acid Dissociation Constant (pKa)

20.02

Base Dissociation Constant (pKb)

5.00

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

19.05

SB56-1015 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 SB56-1015 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB56-1015?
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What is the minimum amount of SB56-1015 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB56-1015
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB56-1015
  • 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 SB56-1015 available by request