K847-0447 Screening compound: 5-methyl-3-[2-oxo-2-(piperidin-1-yl)ethyl]-6-(4-phenylpiperazine-1-carbonyl)-3H,4H-thieno[2,3-d]pyrimidin-4-one

K847-0447 Screening compound: 5-methyl-3-[2-oxo-2-(piperidin-1-yl)ethyl]-6-(4-phenylpiperazine-1-carbonyl)-3H,4H-thieno[2,3-d]pyrimidin-4-one
K847-0447 Screening compound: 5-methyl-3-[2-oxo-2-(piperidin-1-yl)ethyl]-6-(4-phenylpiperazine-1-carbonyl)-3H,4H-thieno[2,3-d]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K847-0447
5-methyl-3-[2-oxo-2-(piperidin-1-yl)ethyl]-6-(4-phenylpiperazine-1-carbonyl)-3H,4H-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

K847-0447

Molecular Formula

C25H29N5O3S (C25 H29 N5 O3 S)

Compound Name

5-methyl-3-[2-oxo-2-(piperidin-1-yl)ethyl]-6-(4-phenylpiperazine-1-carbonyl)-3H,4H-thieno[2,3-d]pyrimidin-4-one

IUPAC name

5-methyl-3-[2-oxo-2-(piperidin-1-yl)ethyl]-6-(4-phenylpiperazine-1-carbonyl)-3H4H-thieno[23-d]pyrimidin-4-one

SMILES

Cc1c(C(N(CC2)CCN2c2ccccc2)=O)sc(N=CN2CC(N3CCCCC3)=O)c1C2=O

InChI

InChI=1S/C25H29N5O3S/c1-18-21-23(26-17-30(24(21)32)16-20(31)28-10-6-3-7-11-28)34-22(18)25(33)29-14-12-27(13-15-29)19-8-4-2-5-9-19/h2,4-5,8-9,17H,3,6-7,10-16H2,1H3

InChI Key

HUCZMWVOPXNSCK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15110674

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.6

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.172

Distribution Coefficient, logD

2.172

Water Solubility, LogSw

-2.41

Polar Surface Area

62.542

Acid Dissociation Constant (pKa)

26.18

Base Dissociation Constant (pKb)

5.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

K847-0447 in Drug Discovery

Included in Screening Libraries

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with K847-0447 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K847-0447?
Check Price and Availability of K847-0447, 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 K847-0447 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K847-0447
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K847-0447
  • 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 K847-0447 available by request