6850-0149 Screening compound: 2-[(7-methoxy-4-methylquinolin-2-yl)sulfanyl]-N-[5-(2-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide

6850-0149 Screening compound: 2-[(7-methoxy-4-methylquinolin-2-yl)sulfanyl]-N-[5-(2-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide
6850-0149 Screening compound: 2-[(7-methoxy-4-methylquinolin-2-yl)sulfanyl]-N-[5-(2-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6850-0149
2-[(7-methoxy-4-methylquinolin-2-yl)sulfanyl]-N-[5-(2-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

6850-0149

Molecular Formula

C22H20N4O2S2 (C22 H20 N4 O2 S2)

Compound Name

2-[(7-methoxy-4-methylquinolin-2-yl)sulfanyl]-N-[5-(2-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide

IUPAC name

2-[(7-methoxy-4-methylquinolin-2-yl)sulfanyl]-N-[5-(2-methylphenyl)-124-thiadiazol-3-yl]acetamide

SMILES

Cc(cccc1)c1-c1nc(NC(CSc2nc3cc(OC)ccc3c(C)c2)=O)ns1

InChI

InChI=1S/C22H20N4O2S2/c1-13-6-4-5-7-17(13)21-25-22(26-30-21)24-19(27)12-29-20-10-14(2)16-9-8-15(28-3)11-18(16)23-20/h4-11H,12H2,1-3H3,(H,24,26,27)

InChI Key

HKLSDWDCPQWIDB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14712143

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.56

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

5.780

Distribution Coefficient, logD

5.780

Water Solubility, LogSw

-5.56

Polar Surface Area

60.033

Acid Dissociation Constant (pKa)

12.17

Base Dissociation Constant (pKb)

1.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

6850-0149 in Drug Discovery

Included in Screening Libraries

Human Receptors Annotated Library (5376 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6850-0149 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6850-0149?
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What is the minimum amount of 6850-0149 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6850-0149
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6850-0149
  • 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 6850-0149 available by request