Y200-6638 Screening compound: ethyl 4-methyl-2-(2-{4-[(2-methylphenyl)methyl]piperazin-1-yl}acetamido)-1,3-thiazole-5-carboxylate

Y200-6638 Screening compound: ethyl 4-methyl-2-(2-{4-[(2-methylphenyl)methyl]piperazin-1-yl}acetamido)-1,3-thiazole-5-carboxylate
Y200-6638 Screening compound: ethyl 4-methyl-2-(2-{4-[(2-methylphenyl)methyl]piperazin-1-yl}acetamido)-1,3-thiazole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y200-6638
ethyl 4-methyl-2-(2-{4-[(2-methylphenyl)methyl]piperazin-1-yl}acetamido)-1,3-thiazole-5-carboxylate

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

Y200-6638

Molecular Formula

C21H28N4O3S (C21 H28 N4 O3 S)

Compound Name

ethyl 4-methyl-2-(2-{4-[(2-methylphenyl)methyl]piperazin-1-yl}acetamido)-1,3-thiazole-5-carboxylate

IUPAC name

ethyl 4-methyl-2-(2-{4-[(2-methylphenyl)methyl]piperazin-1-yl}acetamido)-13-thiazole-5-carboxylate

SMILES

CCOC(c1c(C)nc(NC(CN2CCN(Cc3c(C)cccc3)CC2)=O)s1)=O

InChI

InChI=1S/C21H28N4O3S/c1-4-28-20(27)19-16(3)22-21(29-19)23-18(26)14-25-11-9-24(10-12-25)13-17-8-6-5-7-15(17)2/h5-8H,4,9-14H2,1-3H3,(H,22,23,26)

InChI Key

DRXLOOOHUUOTHI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06053435

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.897

Distribution Coefficient, logD

3.740

Water Solubility, LogSw

-3.77

Polar Surface Area

62.038

Acid Dissociation Constant (pKa)

8.17

Base Dissociation Constant (pKb)

6.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.60

Y200-6638 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with Y200-6638 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y200-6638?
Check Price and Availability of Y200-6638, 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 Y200-6638 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y200-6638
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y200-6638
  • 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 Y200-6638 available by request