P933-0074 Screening compound: 1-[2-(hydroxymethyl)-2-methyl-1-pyrrolidinyl]-2-(3-thienyl)-1-ethanone

P933-0074 Screening compound: 1-[2-(hydroxymethyl)-2-methyl-1-pyrrolidinyl]-2-(3-thienyl)-1-ethanone
P933-0074 Screening compound: 1-[2-(hydroxymethyl)-2-methyl-1-pyrrolidinyl]-2-(3-thienyl)-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound P933-0074
1-[2-(hydroxymethyl)-2-methyl-1-pyrrolidinyl]-2-(3-thienyl)-1-ethanone

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

P933-0074

Molecular Formula

C12H17NO2S (C12 H17 NO2 S)

Compound Name

1-[2-(hydroxymethyl)-2-methyl-1-pyrrolidinyl]-2-(3-thienyl)-1-ethanone

IUPAC name

1-[2-(hydroxymethyl)-2-methylpyrrolidin-1-yl]-2-(thiophen-3-yl)ethan-1-one

SMILES

CC(CO)(CCC1)N1C(Cc1cscc1)=O

InChI

InChI=1S/C12H17NO2S/c1-12(9-14)4-2-5-13(12)11(15)7-10-3-6-16-8-10/h3,6,8,14H,2,4-5,7,9H2,1H3/t12-/m1/s1

InChI Key

NLDGYQKQSQYFME-GFCCVEGCSA-N

MDL Number (MFCD)

MFCD27616159

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

239.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

1.851

Distribution Coefficient, logD

1.851

Water Solubility, LogSw

-1.89

Polar Surface Area

34.339

Acid Dissociation Constant (pKa)

16.08

Base Dissociation Constant (pKb)

-1.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

58.33

P933-0074 in Drug Discovery

Included in Screening Libraries

3D Mimetics PPI Library (1617 compounds)

Protein-Protein Interaction Library (218420 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Structure:
  • Mimetics
  • 3D
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with P933-0074 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P933-0074?
Check Price and Availability of P933-0074, 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 P933-0074 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P933-0074
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P933-0074
  • 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 P933-0074 available by request