C241-2032 Screening compound: 6-(1-{[(3-ethylphenyl)carbamoyl]methyl}-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl)-N-[(4-methylphenyl)methyl]hexanamide

C241-2032 Screening compound: 6-(1-{[(3-ethylphenyl)carbamoyl]methyl}-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl)-N-[(4-methylphenyl)methyl]hexanamide
C241-2032 Screening compound: 6-(1-{[(3-ethylphenyl)carbamoyl]methyl}-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl)-N-[(4-methylphenyl)methyl]hexanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C241-2032
6-(1-{[(3-ethylphenyl)carbamoyl]methyl}-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl)-N-[(4-methylphenyl)methyl]hexanamide

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

C241-2032

Molecular Formula

C30H34N4O4S (C30 H34 N4 O4 S)

Compound Name

6-(1-{[(3-ethylphenyl)carbamoyl]methyl}-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl)-N-[(4-methylphenyl)methyl]hexanamide

IUPAC name

6-(1-{[(3-ethylphenyl)carbamoyl]methyl}-24-dioxo-1H2H3H4H-thieno[32-d]pyrimidin-3-yl)-N-[(4-methylphenyl)methyl]hexanamide

SMILES

CCc1cccc(NC(CN(c2c(C(N3CCCCCC(NCc4ccc(C)cc4)=O)=O)scc2)C3=O)=O)c1

InChI

InChI=1S/C30H34N4O4S/c1-3-22-8-7-9-24(18-22)32-27(36)20-34-25-15-17-39-28(25)29(37)33(30(34)38)16-6-4-5-10-26(35)31-19-23-13-11-21(2)12-14-23/h7-9,11-15,17-18H,3-6,10,16,19-20H2,1-2H3,(H,31,35)(H,32,36)

InChI Key

MTAPEIWBRHMFPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14734831

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

546.69

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.187

Distribution Coefficient, logD

5.187

Water Solubility, LogSw

-4.88

Polar Surface Area

79.884

Acid Dissociation Constant (pKa)

13.01

Base Dissociation Constant (pKb)

0.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

C241-2032 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C241-2032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C241-2032?
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What is the minimum amount of C241-2032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C241-2032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C241-2032
  • 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 C241-2032 available by request