C241-2159 Screening compound: N-[2-(4-chlorophenyl)ethyl]-3-{1-[(diethylcarbamoyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}propanamide

C241-2159 Screening compound: N-[2-(4-chlorophenyl)ethyl]-3-{1-[(diethylcarbamoyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}propanamide
C241-2159 Screening compound: N-[2-(4-chlorophenyl)ethyl]-3-{1-[(diethylcarbamoyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C241-2159
N-[2-(4-chlorophenyl)ethyl]-3-{1-[(diethylcarbamoyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}propanamide

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

C241-2159

Molecular Formula

C23H27ClN4O4S (C23 H27 ClN4 O4 S)

Compound Name

N-[2-(4-chlorophenyl)ethyl]-3-{1-[(diethylcarbamoyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}propanamide

IUPAC name

N-[2-(4-chlorophenyl)ethyl]-3-{1-[(diethylcarbamoyl)methyl]-24-dioxo-1H2H3H4H-thieno[32-d]pyrimidin-3-yl}propanamide

SMILES

CCN(CC)C(CN(c1c(C(N2CCC(NCCc(cc3)ccc3Cl)=O)=O)scc1)C2=O)=O

InChI

InChI=1S/C23H27ClN4O4S/c1-3-26(4-2)20(30)15-28-18-11-14-33-21(18)22(31)27(23(28)32)13-10-19(29)25-12-9-16-5-7-17(24)8-6-16/h5-8,11,14H,3-4,9-10,12-13,15H2,1-2H3,(H,25,29)

InChI Key

FHLVDGKDKZAAMJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14734914

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.01

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.395

Distribution Coefficient, logD

2.395

Water Solubility, LogSw

-3.36

Polar Surface Area

72.253

Acid Dissociation Constant (pKa)

14.04

Base Dissociation Constant (pKb)

7.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

References: we are preparing a list of scientific research reports with C241-2159 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C241-2159?
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What is the minimum amount of C241-2159 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C241-2159
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C241-2159
  • 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 C241-2159 available by request