K889-1535 Screening compound: 2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}-N-({[3-(trifluoromethyl)phenyl]carbamoyl}methyl)acetamide

K889-1535 Screening compound: 2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}-N-({[3-(trifluoromethyl)phenyl]carbamoyl}methyl)acetamide
K889-1535 Screening compound: 2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}-N-({[3-(trifluoromethyl)phenyl]carbamoyl}methyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K889-1535
2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}-N-({[3-(trifluoromethyl)phenyl]carbamoyl}methyl)acetamide

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

K889-1535

Molecular Formula

C19H17F3N4O3S (C19 H17 F3 N4 O3 S)

Compound Name

2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}-N-({[3-(trifluoromethyl)phenyl]carbamoyl}methyl)acetamide

IUPAC name

2-{56-dimethyl-4-oxo-3H4H-thieno[23-d]pyrimidin-3-yl}-N-({[3-(trifluoromethyl)phenyl]carbamoyl}methyl)acetamide

SMILES

Cc1c(C)sc(N=CN2CC(NCC(Nc3cc(C(F)(F)F)ccc3)=O)=O)c1C2=O

InChI

InChI=1S/C19H17F3N4O3S/c1-10-11(2)30-17-16(10)18(29)26(9-24-17)8-15(28)23-7-14(27)25-13-5-3-4-12(6-13)19(20,21)22/h3-6,9H,7-8H2,1-2H3,(H,23,28)(H,25,27)

InChI Key

FZAPAAKHCBBEQY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15111087

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.196

Distribution Coefficient, logD

3.195

Water Solubility, LogSw

-3.48

Polar Surface Area

73.862

Acid Dissociation Constant (pKa)

10.41

Base Dissociation Constant (pKb)

1.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with K889-1535 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K889-1535?
Check Price and Availability of K889-1535, 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 K889-1535 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K889-1535
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K889-1535
  • 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 K889-1535 available by request