C683-0368 Screening compound: 2-(4-ethoxyphenyl)-4-(ethylsulfanyl)-5H-chromeno[2,3-d]pyrimidine

C683-0368 Screening compound: 2-(4-ethoxyphenyl)-4-(ethylsulfanyl)-5H-chromeno[2,3-d]pyrimidine
C683-0368 Screening compound: 2-(4-ethoxyphenyl)-4-(ethylsulfanyl)-5H-chromeno[2,3-d]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound C683-0368
2-(4-ethoxyphenyl)-4-(ethylsulfanyl)-5H-chromeno[2,3-d]pyrimidine

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

C683-0368

Molecular Formula

C21H20N2O2S (C21 H20 N2 O2 S)

Compound Name

2-(4-ethoxyphenyl)-4-(ethylsulfanyl)-5H-chromeno[2,3-d]pyrimidine

IUPAC name

2-(4-ethoxyphenyl)-4-(ethylsulfanyl)-5H-chromeno[23-d]pyrimidine

SMILES

CCOc(cc1)ccc1-c1nc(Oc2c(C3)cccc2)c3c(SCC)n1

InChI

InChI=1S/C21H20N2O2S/c1-3-24-16-11-9-14(10-12-16)19-22-20-17(21(23-19)26-4-2)13-15-7-5-6-8-18(15)25-20/h5-12H,3-4,13H2,1-2H3

InChI Key

AAMKRRISSCLKHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14782569

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.601

Distribution Coefficient, logD

6.598

Water Solubility, LogSw

-6.04

Polar Surface Area

33.526

Acid Dissociation Constant (pKa)

9.55

Base Dissociation Constant (pKb)

2.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

C683-0368 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C683-0368 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C683-0368?
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What is the minimum amount of C683-0368 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C683-0368
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C683-0368
  • 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 C683-0368 available by request