L114-0178 Screening compound: N-(2-chloro-4-methylphenyl)-2-[7-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-3-yl]acetamide

L114-0178 Screening compound: N-(2-chloro-4-methylphenyl)-2-[7-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-3-yl]acetamide
L114-0178 Screening compound: N-(2-chloro-4-methylphenyl)-2-[7-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-3-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L114-0178
N-(2-chloro-4-methylphenyl)-2-[7-(4-methylphenyl)-4-oxo-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

L114-0178

Molecular Formula

C22H18ClN3O2S (C22 H18 ClN3 O2 S)

Compound Name

N-(2-chloro-4-methylphenyl)-2-[7-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-3-yl]acetamide

IUPAC name

N-(2-chloro-4-methylphenyl)-2-[7-(4-methylphenyl)-4-oxo-3H4H-thieno[32-d]pyrimidin-3-yl]acetamide

SMILES

Cc(cc1)ccc1-c1csc2c1N=CN(CC(Nc(ccc(C)c1)c1Cl)=O)C2=O

InChI

InChI=1S/C22H18ClN3O2S/c1-13-3-6-15(7-4-13)16-11-29-21-20(16)24-12-26(22(21)28)10-19(27)25-18-8-5-14(2)9-17(18)23/h3-9,11-12H,10H2,1-2H3,(H,25,27)

InChI Key

PSDQXOZOJMFDCF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16636526

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.92

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.899

Distribution Coefficient, logD

4.899

Water Solubility, LogSw

-4.89

Polar Surface Area

47.285

Acid Dissociation Constant (pKa)

10.90

Base Dissociation Constant (pKb)

-0.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

References: we are preparing a list of scientific research reports with L114-0178 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L114-0178?
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What is the minimum amount of L114-0178 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L114-0178
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L114-0178
  • 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 L114-0178 available by request