C241-1860 Screening compound: N-[(2-chlorophenyl)methyl]-2-[2,4-dioxo-1-({[2-(trifluoromethyl)phenyl]carbamoyl}methyl)-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl]acetamide

C241-1860 Screening compound: N-[(2-chlorophenyl)methyl]-2-[2,4-dioxo-1-({[2-(trifluoromethyl)phenyl]carbamoyl}methyl)-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl]acetamide
C241-1860 Screening compound: N-[(2-chlorophenyl)methyl]-2-[2,4-dioxo-1-({[2-(trifluoromethyl)phenyl]carbamoyl}methyl)-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C241-1860
N-[(2-chlorophenyl)methyl]-2-[2,4-dioxo-1-({[2-(trifluoromethyl)phenyl]carbamoyl}methyl)-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl]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

C241-1860

Molecular Formula

C24H18ClF3N4O4S (C24 H18 ClF3 N4 O4 S)

Compound Name

N-[(2-chlorophenyl)methyl]-2-[2,4-dioxo-1-({[2-(trifluoromethyl)phenyl]carbamoyl}methyl)-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl]acetamide

IUPAC name

N-[(2-chlorophenyl)methyl]-2-[24-dioxo-1-({[2-(trifluoromethyl)phenyl]carbamoyl}methyl)-1H2H3H4H-thieno[32-d]pyrimidin-3-yl]acetamide

SMILES

O=C(CN(C(c(scc1)c1N1CC(Nc2c(C(F)(F)F)cccc2)=O)=O)C1=O)NCc(cccc1)c1Cl

InChI

InChI=1S/C24H18ClF3N4O4S/c25-16-7-3-1-5-14(16)11-29-19(33)12-32-22(35)21-18(9-10-37-21)31(23(32)36)13-20(34)30-17-8-4-2-6-15(17)24(26,27)28/h1-10H,11-13H2,(H,29,33)(H,30,34)

InChI Key

BFMHNCFEOWFTRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14734695

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

550.95

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.300

Distribution Coefficient, logD

4.300

Water Solubility, LogSw

-4.54

Polar Surface Area

79.208

Acid Dissociation Constant (pKa)

12.58

Base Dissociation Constant (pKb)

-0.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

C241-1860 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C241-1860 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C241-1860?
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What is the minimum amount of C241-1860 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C241-1860
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C241-1860
  • 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 C241-1860 available by request