C241-1749 Screening compound: 2-(1-{[(2,4-dimethoxyphenyl)carbamoyl]methyl}-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl)-N-(2-phenylethyl)acetamide

C241-1749 Screening compound: 2-(1-{[(2,4-dimethoxyphenyl)carbamoyl]methyl}-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl)-N-(2-phenylethyl)acetamide
C241-1749 Screening compound: 2-(1-{[(2,4-dimethoxyphenyl)carbamoyl]methyl}-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl)-N-(2-phenylethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C241-1749
2-(1-{[(2,4-dimethoxyphenyl)carbamoyl]methyl}-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl)-N-(2-phenylethyl)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

C241-1749

Molecular Formula

C26H26N4O6S (C26 H26 N4 O6 S)

Compound Name

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

IUPAC name

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

SMILES

COc(cc1)cc(OC)c1NC(CN(c1c(C(N2CC(NCCc3ccccc3)=O)=O)scc1)C2=O)=O

InChI

InChI=1S/C26H26N4O6S/c1-35-18-8-9-19(21(14-18)36-2)28-23(32)16-29-20-11-13-37-24(20)25(33)30(26(29)34)15-22(31)27-12-10-17-6-4-3-5-7-17/h3-9,11,13-14H,10,12,15-16H2,1-2H3,(H,27,31)(H,28,32)

InChI Key

NDABVWASPLIVLH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14734654

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

522.58

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.522

Distribution Coefficient, logD

2.522

Water Solubility, LogSw

-3.03

Polar Surface Area

94.224

Acid Dissociation Constant (pKa)

11.05

Base Dissociation Constant (pKb)

4.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

C241-1749 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 C241-1749 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C241-1749?
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What is the minimum amount of C241-1749 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C241-1749
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C241-1749
  • 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 C241-1749 available by request