E213-0710 Screening compound: 3-METHYL-2-{[4-(2-PYRIMIDINYL)PIPERAZINO]CARBONYL}-6,7,8,9-TETRAHYDRO-4H-PYRIDO[1,2-A]THIENO[2,3-D]PYRIMIDIN-4-ONE

E213-0710 Screening compound: 3-METHYL-2-{[4-(2-PYRIMIDINYL)PIPERAZINO]CARBONYL}-6,7,8,9-TETRAHYDRO-4H-PYRIDO[1,2-A]THIENO[2,3-D]PYRIMIDIN-4-ONE
E213-0710 Screening compound: 3-METHYL-2-{[4-(2-PYRIMIDINYL)PIPERAZINO]CARBONYL}-6,7,8,9-TETRAHYDRO-4H-PYRIDO[1,2-A]THIENO[2,3-D]PYRIMIDIN-4-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound E213-0710
3-METHYL-2-{[4-(2-PYRIMIDINYL)PIPERAZINO]CARBONYL}-6,7,8,9-TETRAHYDRO-4H-PYRIDO[1,2-A]THIENO[2,3-D]PYRIMIDIN-4-ONE

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

E213-0710

Molecular Formula

C20H22N6O2S (C20 H22 N6 O2 S)

Compound Name

3-METHYL-2-{[4-(2-PYRIMIDINYL)PIPERAZINO]CARBONYL}-6,7,8,9-TETRAHYDRO-4H-PYRIDO[1,2-A]THIENO[2,3-D]PYRIMIDIN-4-ONE

IUPAC name

n/a

SMILES

Cc1c(C(N(CC2)CCN2c2ncccn2)=O)sc(N=C2N3CCCC2)c1C3=O

InChI

InChI=1S/C20H22N6O2S/c1-13-15-17(23-14-5-2-3-8-26(14)18(15)27)29-16(13)19(28)24-9-11-25(12-10-24)20-21-6-4-7-22-20/h4,6-7H,2-3,5,8-12H2,1H3

InChI Key

OTUVZTCEBBLOCF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14847348

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.853

Distribution Coefficient, logD

1.853

Water Solubility, LogSw

-1.95

Polar Surface Area

64.562

Acid Dissociation Constant (pKa)

21.08

Base Dissociation Constant (pKb)

3.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.00

E213-0710 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
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 E213-0710 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E213-0710?
Check Price and Availability of E213-0710, 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 E213-0710 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E213-0710
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E213-0710
  • 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 E213-0710 available by request