C203-0057 Screening compound: N-(3,4-dichlorophenyl)-4-({2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}methyl)benzamide

C203-0057 Screening compound: N-(3,4-dichlorophenyl)-4-({2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}methyl)benzamide
C203-0057 Screening compound: N-(3,4-dichlorophenyl)-4-({2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}methyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C203-0057
N-(3,4-dichlorophenyl)-4-({2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}methyl)benzamide

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

C203-0057

Molecular Formula

C20H13Cl2N3O3S (C20 H13 Cl2 N3 O3 S)

Compound Name

N-(3,4-dichlorophenyl)-4-({2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}methyl)benzamide

IUPAC name

N-(34-dichlorophenyl)-4-({24-dioxo-1H2H3H4H-thieno[32-d]pyrimidin-3-yl}methyl)benzamide

SMILES

O=C(c1ccc(CN(C(c(scc2)c2N2)=O)C2=O)cc1)Nc(cc1)cc(Cl)c1Cl

InChI

InChI=1S/C20H13Cl2N3O3S/c21-14-6-5-13(9-15(14)22)23-18(26)12-3-1-11(2-4-12)10-25-19(27)17-16(7-8-29-17)24-20(25)28/h1-9H,10H2,(H,23,26)(H,24,28)

InChI Key

OJCXSGPDWPJTMT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14731883

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.31

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.031

Distribution Coefficient, logD

4.747

Water Solubility, LogSw

-5.40

Polar Surface Area

64.590

Acid Dissociation Constant (pKa)

7.43

Base Dissociation Constant (pKb)

-3.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

C203-0057 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C203-0057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C203-0057?
Check Price and Availability of C203-0057, 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 C203-0057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C203-0057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C203-0057
  • 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 C203-0057 available by request