C241-1159 Screening compound: 2-[3-(3-fluoro-4-methylphenyl)-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl]-N-(2-methylphenyl)acetamide

C241-1159 Screening compound: 2-[3-(3-fluoro-4-methylphenyl)-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl]-N-(2-methylphenyl)acetamide
C241-1159 Screening compound: 2-[3-(3-fluoro-4-methylphenyl)-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl]-N-(2-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C241-1159
2-[3-(3-fluoro-4-methylphenyl)-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl]-N-(2-methylphenyl)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

C241-1159

Molecular Formula

C22H18FN3O3S (C22 H18 FN3 O3 S)

Compound Name

2-[3-(3-fluoro-4-methylphenyl)-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl]-N-(2-methylphenyl)acetamide

IUPAC name

2-[3-(3-fluoro-4-methylphenyl)-24-dioxo-1H2H3H4H-thieno[32-d]pyrimidin-1-yl]-N-(2-methylphenyl)acetamide

SMILES

Cc(cccc1)c1NC(CN(c1c(C(N2c3cc(F)c(C)cc3)=O)scc1)C2=O)=O

InChI

InChI=1S/C22H18FN3O3S/c1-13-7-8-15(11-16(13)23)26-21(28)20-18(9-10-30-20)25(22(26)29)12-19(27)24-17-6-4-3-5-14(17)2/h3-11H,12H2,1-2H3,(H,24,27)

InChI Key

FNTPGKRUMDXYJX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14734226

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.772

Distribution Coefficient, logD

3.772

Water Solubility, LogSw

-3.91

Polar Surface Area

54.125

Acid Dissociation Constant (pKa)

12.67

Base Dissociation Constant (pKb)

1.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

C241-1159 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C241-1159 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C241-1159?
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What is the minimum amount of C241-1159 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C241-1159
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C241-1159
  • 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 C241-1159 available by request