Y021-1477 Screening compound: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[2,2,4-trimethyl-1(2H)-quinolinyl]-1-ethanone

Y021-1477 Screening compound: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[2,2,4-trimethyl-1(2H)-quinolinyl]-1-ethanone
Y021-1477 Screening compound: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[2,2,4-trimethyl-1(2H)-quinolinyl]-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-1477
2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[2,2,4-trimethyl-1(2H)-quinolinyl]-1-ethanone

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

Y021-1477

Molecular Formula

C17H19N3OS2 (C17 H19 N3 OS2)

Compound Name

2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[2,2,4-trimethyl-1(2H)-quinolinyl]-1-ethanone

IUPAC name

2-[(5-methyl-134-thiadiazol-2-yl)sulfanyl]-1-(224-trimethyl-12-dihydroquinolin-1-yl)ethan-1-one

SMILES

CC1(C)N(C(CSc2nnc(C)s2)=O)c(cccc2)c2C(C)=C1

InChI

InChI=1S/C17H19N3OS2/c1-11-9-17(3,4)20(14-8-6-5-7-13(11)14)15(21)10-22-16-19-18-12(2)23-16/h5-9H,10H2,1-4H3

InChI Key

SDNQPTFNMRJBPB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02733199

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.484

Distribution Coefficient, logD

3.484

Water Solubility, LogSw

-3.89

Polar Surface Area

36.468

Acid Dissociation Constant (pKa)

19.23

Base Dissociation Constant (pKb)

-1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.29

References: we are preparing a list of scientific research reports with Y021-1477 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-1477?
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What is the minimum amount of Y021-1477 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-1477
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-1477
  • 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 Y021-1477 available by request