M033-0484 Screening compound: 2-{4-[4-(2-ethyl-1,3-thiazol-4-yl)benzoyl]piperazin-1-yl}pyrimidine

M033-0484 Screening compound: 2-{4-[4-(2-ethyl-1,3-thiazol-4-yl)benzoyl]piperazin-1-yl}pyrimidine
M033-0484 Screening compound: 2-{4-[4-(2-ethyl-1,3-thiazol-4-yl)benzoyl]piperazin-1-yl}pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound M033-0484
2-{4-[4-(2-ethyl-1,3-thiazol-4-yl)benzoyl]piperazin-1-yl}pyrimidine

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

M033-0484

Molecular Formula

C20H21N5OS (C20 H21 N5 OS)

Compound Name

2-{4-[4-(2-ethyl-1,3-thiazol-4-yl)benzoyl]piperazin-1-yl}pyrimidine

IUPAC name

2-{4-[4-(2-ethyl-13-thiazol-4-yl)benzoyl]piperazin-1-yl}pyrimidine

SMILES

CCc1nc(-c(cc2)ccc2C(N(CC2)CCN2c2ncccn2)=O)cs1

InChI

InChI=1S/C20H21N5OS/c1-2-18-23-17(14-27-18)15-4-6-16(7-5-15)19(26)24-10-12-25(13-11-24)20-21-8-3-9-22-20/h3-9,14H,2,10-13H2,1H3

InChI Key

KLNBYIURJYFSJA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27493881

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.700

Distribution Coefficient, logD

3.700

Water Solubility, LogSw

-3.81

Polar Surface Area

48.739

Acid Dissociation Constant (pKa)

21.00

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

M033-0484 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M033-0484 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M033-0484?
Check Price and Availability of M033-0484, 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 M033-0484 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M033-0484
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M033-0484
  • 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 M033-0484 available by request