SB56-0716 Screening compound: 5-[(3S,4R)-1-(ethylsulfonyl)-4-(3-pyridyl)tetrahydro-1H-pyrrol-3-yl]-3-(4-pyridyl)-1,2,4-oxadiazole

SB56-0716 Screening compound: 5-[(3S,4R)-1-(ethylsulfonyl)-4-(3-pyridyl)tetrahydro-1H-pyrrol-3-yl]-3-(4-pyridyl)-1,2,4-oxadiazole
SB56-0716 Screening compound: 5-[(3S,4R)-1-(ethylsulfonyl)-4-(3-pyridyl)tetrahydro-1H-pyrrol-3-yl]-3-(4-pyridyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound SB56-0716
5-[(3S,4R)-1-(ethylsulfonyl)-4-(3-pyridyl)tetrahydro-1H-pyrrol-3-yl]-3-(4-pyridyl)-1,2,4-oxadiazole

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

SB56-0716

Molecular Formula

C18H19N5O3S (C18 H19 N5 O3 S)

Compound Name

5-[(3S,4R)-1-(ethylsulfonyl)-4-(3-pyridyl)tetrahydro-1H-pyrrol-3-yl]-3-(4-pyridyl)-1,2,4-oxadiazole

IUPAC name

4-{5-[(3S4R)-1-(ethanesulfonyl)-4-(pyridin-3-yl)pyrrolidin-3-yl]-124-oxadiazol-3-yl}pyridine

SMILES

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

InChI

InChI=1S/C18H19N5O3S/c1-2-27(24,25)23-11-15(14-4-3-7-20-10-14)16(12-23)18-21-17(22-26-18)13-5-8-19-9-6-13/h3-10,15-16H,2,11-12H2,1H3/t15-,16+/m0/s1

InChI Key

ZDCJZTWMESSOKX-JKSUJKDBSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.45

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.864

Distribution Coefficient, logD

1.862

Water Solubility, LogSw

-2.14

Polar Surface Area

82.428

Acid Dissociation Constant (pKa)

20.03

Base Dissociation Constant (pKb)

4.99

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

33.33

SB56-0716 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SB56-0716 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB56-0716?
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What is the minimum amount of SB56-0716 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB56-0716
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB56-0716
  • 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 SB56-0716 available by request