C241-1904 Screening compound: N-[(2-chlorophenyl)methyl]-2-{1-[(4-methylphenyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}acetamide

C241-1904 Screening compound: N-[(2-chlorophenyl)methyl]-2-{1-[(4-methylphenyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}acetamide
C241-1904 Screening compound: N-[(2-chlorophenyl)methyl]-2-{1-[(4-methylphenyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C241-1904
N-[(2-chlorophenyl)methyl]-2-{1-[(4-methylphenyl)methyl]-2,4-dioxo-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

C241-1904

Molecular Formula

C23H20ClN3O3S (C23 H20 ClN3 O3 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1ccc(CN(c2c(C(N3CC(NCc(cccc4)c4Cl)=O)=O)scc2)C3=O)cc1

InChI

InChI=1S/C23H20ClN3O3S/c1-15-6-8-16(9-7-15)13-26-19-10-11-31-21(19)22(29)27(23(26)30)14-20(28)25-12-17-4-2-3-5-18(17)24/h2-11H,12-14H2,1H3,(H,25,28)

InChI Key

GQZPRVHFDDXCHZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14734730

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.95

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.802

Distribution Coefficient, logD

4.802

Water Solubility, LogSw

-4.72

Polar Surface Area

56.757

Acid Dissociation Constant (pKa)

13.62

Base Dissociation Constant (pKb)

-1.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with C241-1904 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C241-1904
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C241-1904
  • 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 C241-1904 available by request