SC41-0130 Screening compound: 2,3-dihydro-1H-inden-5-yl [3-fluoro-3-(5-phenyl-1,2,4-oxadiazol-3-yl)-1-pyrrolidinyl] sulfone

SC41-0130 Screening compound: 2,3-dihydro-1H-inden-5-yl [3-fluoro-3-(5-phenyl-1,2,4-oxadiazol-3-yl)-1-pyrrolidinyl] sulfone
SC41-0130 Screening compound: 2,3-dihydro-1H-inden-5-yl [3-fluoro-3-(5-phenyl-1,2,4-oxadiazol-3-yl)-1-pyrrolidinyl] sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound SC41-0130
2,3-dihydro-1H-inden-5-yl [3-fluoro-3-(5-phenyl-1,2,4-oxadiazol-3-yl)-1-pyrrolidinyl] sulfone

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

SC41-0130

Molecular Formula

C21H20FN3O3S (C21 H20 FN3 O3 S)

Compound Name

2,3-dihydro-1H-inden-5-yl [3-fluoro-3-(5-phenyl-1,2,4-oxadiazol-3-yl)-1-pyrrolidinyl] sulfone

IUPAC name

3-[1-(23-dihydro-1H-indene-5-sulfonyl)-3-fluoropyrrolidin-3-yl]-5-phenyl-124-oxadiazole

SMILES

O=S(c1cc(CCC2)c2cc1)(N(CC1)CC1(c1noc(-c2ccccc2)n1)F)=O

InChI

InChI=1S/C21H20FN3O3S/c22-21(20-23-19(28-24-20)16-5-2-1-3-6-16)11-12-25(14-21)29(26,27)18-10-9-15-7-4-8-17(15)13-18/h1-3,5-6,9-10,13H,4,7-8,11-12,14H2/t21-/m0/s1

InChI Key

OVMBYRDMNSTLSJ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD32258717

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.714

Distribution Coefficient, logD

4.714

Water Solubility, LogSw

-4.70

Polar Surface Area

63.941

Acid Dissociation Constant (pKa)

20.77

Base Dissociation Constant (pKb)

-4.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.33

SC41-0130 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 SC41-0130 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC41-0130?
Check Price and Availability of SC41-0130, 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 SC41-0130 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC41-0130
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC41-0130
  • 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 SC41-0130 available by request