E514-0687 Screening compound: 5-ethyl-8-({[5-methyl-2-(2-thienyl)-1,3-oxazol-4-yl]methyl}sulfanyl)furo[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine

E514-0687 Screening compound: 5-ethyl-8-({[5-methyl-2-(2-thienyl)-1,3-oxazol-4-yl]methyl}sulfanyl)furo[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
E514-0687 Screening compound: 5-ethyl-8-({[5-methyl-2-(2-thienyl)-1,3-oxazol-4-yl]methyl}sulfanyl)furo[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E514-0687
5-ethyl-8-({[5-methyl-2-(2-thienyl)-1,3-oxazol-4-yl]methyl}sulfanyl)furo[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine

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

E514-0687

Molecular Formula

C19H16N4O2S2 (C19 H16 N4 O2 S2)

Compound Name

5-ethyl-8-({[5-methyl-2-(2-thienyl)-1,3-oxazol-4-yl]methyl}sulfanyl)furo[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine

IUPAC name

12-ethyl-9-({[5-methyl-2-(thiophen-2-yl)-13-oxazol-4-yl]methyl}sulfanyl)-5-oxa-11011-triazatricyclo[6.4.0.0^{26}]dodeca-2(6)37911-pentaene

SMILES

CCc(n1c2cc3c1cco3)nnc2SCc1c(C)oc(-c2cccs2)n1

InChI

InChI=1S/C19H16N4O2S2/c1-3-17-21-22-19(14-9-15-13(23(14)17)6-7-24-15)27-10-12-11(2)25-18(20-12)16-5-4-8-26-16/h4-9H,3,10H2,1-2H3

InChI Key

PKXKNAWRDCOTMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14893864

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.192

Distribution Coefficient, logD

4.188

Water Solubility, LogSw

-4.25

Polar Surface Area

48.908

Acid Dissociation Constant (pKa)

23.64

Base Dissociation Constant (pKb)

5.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

E514-0687 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 E514-0687 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E514-0687?
Check Price and Availability of E514-0687, 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 E514-0687 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E514-0687
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E514-0687
  • 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 E514-0687 available by request