6850-0209 Screening compound: 2-{[5-(furan-2-yl)-4-oxo-3-(prop-2-en-1-yl)-3H,4H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide

6850-0209 Screening compound: 2-{[5-(furan-2-yl)-4-oxo-3-(prop-2-en-1-yl)-3H,4H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide
6850-0209 Screening compound: 2-{[5-(furan-2-yl)-4-oxo-3-(prop-2-en-1-yl)-3H,4H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6850-0209
2-{[5-(furan-2-yl)-4-oxo-3-(prop-2-en-1-yl)-3H,4H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-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

6850-0209

Molecular Formula

C24H19N5O3S3 (C24 H19 N5 O3 S3)

Compound Name

2-{[5-(furan-2-yl)-4-oxo-3-(prop-2-en-1-yl)-3H,4H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide

IUPAC name

2-{[5-(furan-2-yl)-4-oxo-3-(prop-2-en-1-yl)-3H4H-thieno[23-d]pyrimidin-2-yl]sulfanyl}-N-[5-(4-methylphenyl)-124-thiadiazol-3-yl]acetamide

SMILES

Cc(cc1)ccc1-c1nc(NC(CSC(N2CC=C)=Nc(scc3-c4ccco4)c3C2=O)=O)ns1

InChI

InChI=1S/C24H19N5O3S3/c1-3-10-29-22(31)19-16(17-5-4-11-32-17)12-33-21(19)27-24(29)34-13-18(30)25-23-26-20(35-28-23)15-8-6-14(2)7-9-15/h3-9,11-12H,1,10,13H2,2H3,(H,25,28,30)

InChI Key

QRFOEQJNKXBORN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14712156

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

521.64

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.143

Distribution Coefficient, logD

5.143

Water Solubility, LogSw

-4.99

Polar Surface Area

79.060

Acid Dissociation Constant (pKa)

11.73

Base Dissociation Constant (pKb)

-2.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with 6850-0209 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6850-0209?
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What is the minimum amount of 6850-0209 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6850-0209
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6850-0209
  • 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 6850-0209 available by request