Y020-1636 Screening compound: N-(3-chloro-2-methylphenyl)-2-(3-oxothiomorpholin-2-yl)acetamide

Y020-1636 Screening compound: N-(3-chloro-2-methylphenyl)-2-(3-oxothiomorpholin-2-yl)acetamide
Y020-1636 Screening compound: N-(3-chloro-2-methylphenyl)-2-(3-oxothiomorpholin-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-1636
N-(3-chloro-2-methylphenyl)-2-(3-oxothiomorpholin-2-yl)acetamide

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

Y020-1636

Molecular Formula

C13H15ClN2O2S (C13 H15 ClN2 O2 S)

Compound Name

N-(3-chloro-2-methylphenyl)-2-(3-oxothiomorpholin-2-yl)acetamide

IUPAC name

N-(3-chloro-2-methylphenyl)-2-(3-oxothiomorpholin-2-yl)acetamide

SMILES

Cc(c(NC(CC1SCCNC1=O)=O)ccc1)c1Cl

InChI

InChI=1S/C13H15ClN2O2S/c1-8-9(14)3-2-4-10(8)16-12(17)7-11-13(18)15-5-6-19-11/h2-4,11H,5-7H2,1H3,(H,15,18)(H,16,17)/t11-/m0/s1

InChI Key

FAGPNXBZONJRLT-NSHDSACASA-N

MDL Number (MFCD)

MFCD06606454

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.79

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.710

Distribution Coefficient, logD

1.709

Water Solubility, LogSw

-2.43

Polar Surface Area

47.691

Acid Dissociation Constant (pKa)

10.33

Base Dissociation Constant (pKb)

-0.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

Y020-1636 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with Y020-1636 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-1636?
Check Price and Availability of Y020-1636, 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 Y020-1636 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-1636
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-1636
  • 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 Y020-1636 available by request