K889-0797 Screening compound: [5-methyl-4-(4-methylpiperidino)thieno[2,3-d]pyrimidin-6-yl][4-(2-pyridyl)piperazino]methanone

K889-0797 Screening compound: [5-methyl-4-(4-methylpiperidino)thieno[2,3-d]pyrimidin-6-yl][4-(2-pyridyl)piperazino]methanone
K889-0797 Screening compound: [5-methyl-4-(4-methylpiperidino)thieno[2,3-d]pyrimidin-6-yl][4-(2-pyridyl)piperazino]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound K889-0797
[5-methyl-4-(4-methylpiperidino)thieno[2,3-d]pyrimidin-6-yl][4-(2-pyridyl)piperazino]methanone

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

K889-0797

Molecular Formula

C23H28N6OS (C23 H28 N6 OS)

Compound Name

[5-methyl-4-(4-methylpiperidino)thieno[2,3-d]pyrimidin-6-yl][4-(2-pyridyl)piperazino]methanone

IUPAC name

1-[5-methyl-4-(4-methylpiperidin-1-yl)thieno[23-d]pyrimidine-6-carbonyl]-4-(pyridin-2-yl)piperazine

SMILES

CC(CC1)CCN1c1c(c(C)c(C(N(CC2)CCN2c2ncccc2)=O)s2)c2ncn1

InChI

InChI=1S/C23H28N6OS/c1-16-6-9-28(10-7-16)21-19-17(2)20(31-22(19)26-15-25-21)23(30)29-13-11-27(12-14-29)18-5-3-4-8-24-18/h3-5,8,15-16H,6-7,9-14H2,1-2H3

InChI Key

SAXWLXGXHKPEES-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15111020

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.58

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.590

Distribution Coefficient, logD

4.476

Water Solubility, LogSw

-4.52

Polar Surface Area

52.958

Acid Dissociation Constant (pKa)

21.66

Base Dissociation Constant (pKb)

6.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.83

K889-0797 in Drug Discovery

Included in Screening Libraries

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

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K889-0797 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K889-0797?
Check Price and Availability of K889-0797, 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 K889-0797 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K889-0797
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K889-0797
  • 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 K889-0797 available by request