SB34-0096 Screening compound: 2,3-dihydro-1H-inden-5-yl [(3S,4S)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-1-yl] sulfone

SB34-0096 Screening compound: 2,3-dihydro-1H-inden-5-yl [(3S,4S)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-1-yl] sulfone
SB34-0096 Screening compound: 2,3-dihydro-1H-inden-5-yl [(3S,4S)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-1-yl] sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound SB34-0096
2,3-dihydro-1H-inden-5-yl [(3S,4S)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-1-yl] 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

SB34-0096

Molecular Formula

C17H21FN4O2S (C17 H21 FN4 O2 S)

Compound Name

2,3-dihydro-1H-inden-5-yl [(3S,4S)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-1-yl] sulfone

IUPAC name

5-[(3S4S)-1-(23-dihydro-1H-indene-5-sulfonyl)-4-(fluoromethyl)pyrrolidin-3-yl]-3-methyl-1H-124-triazole

SMILES

Cc1n[nH]c([C@@H](C2)[C@@H](CF)CN2S(c2cc(CCC3)c3cc2)(=O)=O)n1

InChI

InChI=1S/C17H21FN4O2S/c1-11-19-17(21-20-11)16-10-22(9-14(16)8-18)25(23,24)15-6-5-12-3-2-4-13(12)7-15/h5-7,14,16H,2-4,8-10H2,1H3,(H,19,20,21)/t14-,16-/m1/s1

InChI Key

XZUIKIDZVFCLBP-GDBMZVCRSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.224

Distribution Coefficient, logD

2.223

Water Solubility, LogSw

-2.96

Polar Surface Area

65.867

Acid Dissociation Constant (pKa)

10.37

Base Dissociation Constant (pKb)

3.18

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

52.94

References: we are preparing a list of scientific research reports with SB34-0096 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB34-0096?
Check Price and Availability of SB34-0096, 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 SB34-0096 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB34-0096
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB34-0096
  • 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 SB34-0096 available by request