K936-0088 Screening compound: 2-{6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}-N-propylacetamide

K936-0088 Screening compound: 2-{6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}-N-propylacetamide
K936-0088 Screening compound: 2-{6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}-N-propylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K936-0088
2-{6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}-N-propylacetamide

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

K936-0088

Molecular Formula

C23H26ClN5O3S (C23 H26 ClN5 O3 S)

Compound Name

2-{6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}-N-propylacetamide

IUPAC name

2-{6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-5-methyl-4-oxo-3H4H-thieno[23-d]pyrimidin-3-yl}-N-propylacetamide

SMILES

CCCNC(CN(C=Nc1c2c(C)c(C(N(CC3)CCN3c3cccc(Cl)c3)=O)s1)C2=O)=O

InChI

InChI=1S/C23H26ClN5O3S/c1-3-7-25-18(30)13-29-14-26-21-19(22(29)31)15(2)20(33-21)23(32)28-10-8-27(9-11-28)17-6-4-5-16(24)12-17/h4-6,12,14H,3,7-11,13H2,1-2H3,(H,25,30)

InChI Key

MIZIZEGIHJBLNM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15114663

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

488.01

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.450

Distribution Coefficient, logD

2.450

Water Solubility, LogSw

-3.74

Polar Surface Area

70.734

Acid Dissociation Constant (pKa)

15.94

Base Dissociation Constant (pKb)

1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

K936-0088 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 K936-0088 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K936-0088?
Check Price and Availability of K936-0088, 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 K936-0088 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K936-0088
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K936-0088
  • 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 K936-0088 available by request