C242-0830 Screening compound: 2-{5,6-dimethyl-2,4-dioxo-3-phenyl-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl}-N-(4-methoxyphenyl)acetamide

C242-0830 Screening compound: 2-{5,6-dimethyl-2,4-dioxo-3-phenyl-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl}-N-(4-methoxyphenyl)acetamide
C242-0830 Screening compound: 2-{5,6-dimethyl-2,4-dioxo-3-phenyl-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl}-N-(4-methoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C242-0830
2-{5,6-dimethyl-2,4-dioxo-3-phenyl-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl}-N-(4-methoxyphenyl)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

C242-0830

Molecular Formula

C23H21N3O4S (C23 H21 N3 O4 S)

Compound Name

2-{5,6-dimethyl-2,4-dioxo-3-phenyl-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl}-N-(4-methoxyphenyl)acetamide

IUPAC name

2-{56-dimethyl-24-dioxo-3-phenyl-1H2H3H4H-thieno[23-d]pyrimidin-1-yl}-N-(4-methoxyphenyl)acetamide

SMILES

Cc1c(C)sc(N(CC(Nc(cc2)ccc2OC)=O)C(N2c3ccccc3)=O)c1C2=O

InChI

InChI=1S/C23H21N3O4S/c1-14-15(2)31-22-20(14)21(28)26(17-7-5-4-6-8-17)23(29)25(22)13-19(27)24-16-9-11-18(30-3)12-10-16/h4-12H,13H2,1-3H3,(H,24,27)

InChI Key

BNDTZWMIKVLMBH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14735053

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.866

Distribution Coefficient, logD

3.866

Water Solubility, LogSw

-4.28

Polar Surface Area

61.800

Acid Dissociation Constant (pKa)

12.69

Base Dissociation Constant (pKb)

4.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with C242-0830 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C242-0830?
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What is the minimum amount of C242-0830 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C242-0830
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C242-0830
  • 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 C242-0830 available by request