6850-0225 Screening compound: 2-{[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide

6850-0225 Screening compound: 2-{[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide
6850-0225 Screening compound: 2-{[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6850-0225
2-{[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-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

6850-0225

Molecular Formula

C23H16ClN5OS3 (C23 H16 ClN5 OS3)

Compound Name

2-{[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide

IUPAC name

2-{[5-(4-chlorophenyl)thieno[23-d]pyrimidin-4-yl]sulfanyl}-N-[5-(4-methylphenyl)-124-thiadiazol-3-yl]acetamide

SMILES

Cc(cc1)ccc1-c1nc(NC(CSc2c(c(-c(cc3)ccc3Cl)cs3)c3ncn2)=O)ns1

InChI

InChI=1S/C23H16ClN5OS3/c1-13-2-4-15(5-3-13)20-28-23(29-33-20)27-18(30)11-32-22-19-17(10-31-21(19)25-12-26-22)14-6-8-16(24)9-7-14/h2-10,12H,11H2,1H3,(H,27,29,30)

InChI Key

YRSRVIBKCRQAFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14712170

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

510.06

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.812

Distribution Coefficient, logD

6.812

Water Solubility, LogSw

-6.27

Polar Surface Area

65.572

Acid Dissociation Constant (pKa)

11.48

Base Dissociation Constant (pKb)

2.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

References: we are preparing a list of scientific research reports with 6850-0225 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6850-0225?
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What is the minimum amount of 6850-0225 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6850-0225
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6850-0225
  • 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 6850-0225 available by request