2198-4009 Screening compound: 3-(4-chlorophenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one

2198-4009 Screening compound: 3-(4-chlorophenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one
2198-4009 Screening compound: 3-(4-chlorophenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2198-4009
3-(4-chlorophenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-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

2198-4009

Molecular Formula

C14H11ClN2OS (C14 H11 ClN2 OS)

Compound Name

3-(4-chlorophenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one

IUPAC name

3-(4-chlorophenyl)-56-dimethyl-3H4H-thieno[23-d]pyrimidin-4-one

SMILES

Cc1c(C)sc(N=CN2c(cc3)ccc3Cl)c1C2=O

InChI

InChI=1S/C14H11ClN2OS/c1-8-9(2)19-13-12(8)14(18)17(7-16-13)11-5-3-10(15)4-6-11/h3-7H,1-2H3

InChI Key

UWJGRNZEKFBJDM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01447243

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

290.77

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.429

Distribution Coefficient, logD

3.429

Water Solubility, LogSw

-4.33

Polar Surface Area

25.795

Acid Dissociation Constant (pKa)

27.76

Base Dissociation Constant (pKb)

3.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.29

References: we are preparing a list of scientific research reports with 2198-4009 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2198-4009?
Check Price and Availability of 2198-4009, 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 2198-4009 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2198-4009
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2198-4009
  • 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 2198-4009 available by request