P930-2238 Screening compound: 3-ethyl-5-[1-(thiophene-2-sulfonyl)pyrrolidin-2-yl]-4H-1,2,4-triazole

P930-2238 Screening compound: 3-ethyl-5-[1-(thiophene-2-sulfonyl)pyrrolidin-2-yl]-4H-1,2,4-triazole
P930-2238 Screening compound: 3-ethyl-5-[1-(thiophene-2-sulfonyl)pyrrolidin-2-yl]-4H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound P930-2238
3-ethyl-5-[1-(thiophene-2-sulfonyl)pyrrolidin-2-yl]-4H-1,2,4-triazole

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

P930-2238

Molecular Formula

C12H16N4O2S2 (C12 H16 N4 O2 S2)

Compound Name

3-ethyl-5-[1-(thiophene-2-sulfonyl)pyrrolidin-2-yl]-4H-1,2,4-triazole

IUPAC name

3-ethyl-5-[(2S)-1-(thiophene-2-sulfonyl)pyrrolidin-2-yl]-4H-124-triazole

SMILES

CCc1nnc([C@H](CCC2)N2S(c2cccs2)(=O)=O)[nH]1

InChI

InChI=1S/C12H16N4O2S2/c1-2-10-13-12(15-14-10)9-5-3-7-16(9)20(17,18)11-6-4-8-19-11/h4,6,8-9H,2-3,5,7H2,1H3,(H,13,14,15)/t9-/m0/s1

InChI Key

DSWHMWNFUFVSMS-VIFPVBQESA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.42

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

1.135

Distribution Coefficient, logD

1.130

Water Solubility, LogSw

-2.21

Polar Surface Area

68.580

Acid Dissociation Constant (pKa)

7.70

Base Dissociation Constant (pKb)

5.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

P930-2238 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P930-2238 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P930-2238?
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What is the minimum amount of P930-2238 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P930-2238
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P930-2238
  • 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 P930-2238 available by request