SC41-0132 Screening compound: 3-{1-[(4-chlorobenzyl)sulfonyl]-3-fluorotetrahydro-1H-pyrrol-3-yl}-5-phenyl-1,2,4-oxadiazole

SC41-0132 Screening compound: 3-{1-[(4-chlorobenzyl)sulfonyl]-3-fluorotetrahydro-1H-pyrrol-3-yl}-5-phenyl-1,2,4-oxadiazole
SC41-0132 Screening compound: 3-{1-[(4-chlorobenzyl)sulfonyl]-3-fluorotetrahydro-1H-pyrrol-3-yl}-5-phenyl-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound SC41-0132
3-{1-[(4-chlorobenzyl)sulfonyl]-3-fluorotetrahydro-1H-pyrrol-3-yl}-5-phenyl-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

SC41-0132

Molecular Formula

C19H17ClFN3O3S (C19 H17 ClFN3 O3 S)

Compound Name

3-{1-[(4-chlorobenzyl)sulfonyl]-3-fluorotetrahydro-1H-pyrrol-3-yl}-5-phenyl-1,2,4-oxadiazole

IUPAC name

3-{1-[(4-chlorophenyl)methanesulfonyl]-3-fluoropyrrolidin-3-yl}-5-phenyl-124-oxadiazole

SMILES

O=S(Cc(cc1)ccc1Cl)(N(CC1)CC1(c1noc(-c2ccccc2)n1)F)=O

InChI

InChI=1S/C19H17ClFN3O3S/c20-16-8-6-14(7-9-16)12-28(25,26)24-11-10-19(21,13-24)18-22-17(27-23-18)15-4-2-1-3-5-15/h1-9H,10-13H2/t19-/m0/s1

InChI Key

CGBRDMUAGNJTAV-IBGZPJMESA-N

MDL Number (MFCD)

MFCD32258719

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.88

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.986

Distribution Coefficient, logD

3.986

Water Solubility, LogSw

-4.62

Polar Surface Area

63.549

Acid Dissociation Constant (pKa)

20.14

Base Dissociation Constant (pKb)

-6.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.32

SC41-0132 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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 SC41-0132 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC41-0132?
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What is the minimum amount of SC41-0132 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC41-0132
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC41-0132
  • 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 SC41-0132 available by request