E776-0488 Screening compound: 2-[4-(4-{5-methyl-4-[(phenylsulfanyl)methyl]-1,3-oxazol-2-yl}benzoyl)piperazin-1-yl]pyrimidine

E776-0488 Screening compound: 2-[4-(4-{5-methyl-4-[(phenylsulfanyl)methyl]-1,3-oxazol-2-yl}benzoyl)piperazin-1-yl]pyrimidine
E776-0488 Screening compound: 2-[4-(4-{5-methyl-4-[(phenylsulfanyl)methyl]-1,3-oxazol-2-yl}benzoyl)piperazin-1-yl]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound E776-0488
2-[4-(4-{5-methyl-4-[(phenylsulfanyl)methyl]-1,3-oxazol-2-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

E776-0488

Molecular Formula

C26H25N5O2S (C26 H25 N5 O2 S)

Compound Name

2-[4-(4-{5-methyl-4-[(phenylsulfanyl)methyl]-1,3-oxazol-2-yl}benzoyl)piperazin-1-yl]pyrimidine

IUPAC name

2-[4-(4-{5-methyl-4-[(phenylsulfanyl)methyl]-13-oxazol-2-yl}benzoyl)piperazin-1-yl]pyrimidine

SMILES

Cc1c(CSc2ccccc2)nc(-c(cc2)ccc2C(N(CC2)CCN2c2ncccn2)=O)o1

InChI

InChI=1S/C26H25N5O2S/c1-19-23(18-34-22-6-3-2-4-7-22)29-24(33-19)20-8-10-21(11-9-20)25(32)30-14-16-31(17-15-30)26-27-12-5-13-28-26/h2-13H,14-18H2,1H3

InChI Key

MJQRCDPAWYYLCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14917968

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.268

Distribution Coefficient, logD

4.268

Water Solubility, LogSw

-4.21

Polar Surface Area

56.360

Acid Dissociation Constant (pKa)

21.00

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

E776-0488 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with E776-0488 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E776-0488?
Check Price and Availability of E776-0488, 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 E776-0488 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E776-0488
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E776-0488
  • 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 E776-0488 available by request