F993-0437 Screening compound: N-(2-cyanoethyl)-1,3-dimethyl-2,4-dioxo-N-phenyl-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

F993-0437 Screening compound: N-(2-cyanoethyl)-1,3-dimethyl-2,4-dioxo-N-phenyl-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide
F993-0437 Screening compound: N-(2-cyanoethyl)-1,3-dimethyl-2,4-dioxo-N-phenyl-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F993-0437
N-(2-cyanoethyl)-1,3-dimethyl-2,4-dioxo-N-phenyl-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

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

F993-0437

Molecular Formula

C18H16N4O3S (C18 H16 N4 O3 S)

Compound Name

N-(2-cyanoethyl)-1,3-dimethyl-2,4-dioxo-N-phenyl-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

IUPAC name

N-(2-cyanoethyl)-13-dimethyl-24-dioxo-N-phenyl-1H2H3H4H-thieno[23-d]pyrimidine-6-carboxamide

SMILES

CN(c(sc(C(N(CCC#N)c1ccccc1)=O)c1)c1C(N1C)=O)C1=O

InChI

InChI=1S/C18H16N4O3S/c1-20-15(23)13-11-14(26-17(13)21(2)18(20)25)16(24)22(10-6-9-19)12-7-4-3-5-8-12/h3-5,7-8,11H,6,10H2,1-2H3

InChI Key

QOCGVPUTMAOPQH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27208594

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.245

Distribution Coefficient, logD

2.245

Water Solubility, LogSw

-3.03

Polar Surface Area

64.886

Acid Dissociation Constant (pKa)

21.44

Base Dissociation Constant (pKb)

-4.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with F993-0437 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F993-0437?
Check Price and Availability of F993-0437, 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 F993-0437 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F993-0437
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F993-0437
  • 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 F993-0437 available by request