C203-0060 Screening compound: 4-({2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}methyl)-N-phenylbenzamide

C203-0060 Screening compound: 4-({2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}methyl)-N-phenylbenzamide
C203-0060 Screening compound: 4-({2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}methyl)-N-phenylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C203-0060
4-({2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}methyl)-N-phenylbenzamide

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

C203-0060

Molecular Formula

C20H15N3O3S (C20 H15 N3 O3 S)

Compound Name

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

IUPAC name

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

SMILES

O=C(c1ccc(CN(C(c(scc2)c2N2)=O)C2=O)cc1)Nc1ccccc1

InChI

InChI=1S/C20H15N3O3S/c24-18(21-15-4-2-1-3-5-15)14-8-6-13(7-9-14)12-23-19(25)17-16(10-11-27-17)22-20(23)26/h1-11H,12H2,(H,21,24)(H,22,26)

InChI Key

MCFFMJLAVBXWHY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14731885

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.42

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

3.365

Distribution Coefficient, logD

3.365

Water Solubility, LogSw

-3.60

Polar Surface Area

64.590

Acid Dissociation Constant (pKa)

10.87

Base Dissociation Constant (pKb)

-2.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

C203-0060 in Drug Discovery

Included in Screening Libraries

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C203-0060 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C203-0060?
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What is the minimum amount of C203-0060 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C203-0060
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C203-0060
  • 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 C203-0060 available by request