2293-4402 Screening compound: 1-(2-methoxyphenyl)-3-(2-methylpropanoyl)thiourea

2293-4402 Screening compound: 1-(2-methoxyphenyl)-3-(2-methylpropanoyl)thiourea
2293-4402 Screening compound: 1-(2-methoxyphenyl)-3-(2-methylpropanoyl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound 2293-4402
1-(2-methoxyphenyl)-3-(2-methylpropanoyl)thiourea

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

2293-4402

Molecular Formula

C12H16N2O2S (C12 H16 N2 O2 S)

Compound Name

1-(2-methoxyphenyl)-3-(2-methylpropanoyl)thiourea

IUPAC name

1-(2-methoxyphenyl)-3-(2-methylpropanoyl)thiourea

SMILES

CC(C)C(NC(Nc(cccc1)c1OC)=S)=O

InChI

InChI=1S/C12H16N2O2S/c1-8(2)11(15)14-12(17)13-9-6-4-5-7-10(9)16-3/h4-8H,1-3H3,(H2,13,14,15,17)

InChI Key

BHXXVDHXSBMVDI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01470049

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

252.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.584

Distribution Coefficient, logD

2.583

Water Solubility, LogSw

-3.19

Polar Surface Area

40.444

Acid Dissociation Constant (pKa)

10.08

Base Dissociation Constant (pKb)

-1.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

2293-4402 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 2293-4402 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2293-4402?
Check Price and Availability of 2293-4402, 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 2293-4402 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2293-4402
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2293-4402
  • 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 2293-4402 available by request