Y020-6464 Screening compound: [(4,5-diphenyl-1,3-oxazol-2-yl)carbamoyl]methyl 3,5-dimethylpiperidine-1-carbodithioate

Y020-6464 Screening compound: [(4,5-diphenyl-1,3-oxazol-2-yl)carbamoyl]methyl 3,5-dimethylpiperidine-1-carbodithioate
Y020-6464 Screening compound: [(4,5-diphenyl-1,3-oxazol-2-yl)carbamoyl]methyl 3,5-dimethylpiperidine-1-carbodithioate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-6464
[(4,5-diphenyl-1,3-oxazol-2-yl)carbamoyl]methyl 3,5-dimethylpiperidine-1-carbodithioate

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

Y020-6464

Molecular Formula

C25H27N3O2S2 (C25 H27 N3 O2 S2)

Compound Name

[(4,5-diphenyl-1,3-oxazol-2-yl)carbamoyl]methyl 3,5-dimethylpiperidine-1-carbodithioate

IUPAC name

[(45-diphenyl-13-oxazol-2-yl)carbamoyl]methyl 35-dimethylpiperidine-1-carbodithioate

SMILES

CC(CC(C)C1)CN1C(SCC(Nc1nc(-c2ccccc2)c(-c2ccccc2)o1)=O)=S

InChI

InChI=1S/C25H27N3O2S2/c1-17-13-18(2)15-28(14-17)25(31)32-16-21(29)26-24-27-22(19-9-5-3-6-10-19)23(30-24)20-11-7-4-8-12-20/h3-12,17-18H,13-16H2,1-2H3,(H,26,27,29)

InChI Key

IEPRGMGODAQGHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04173240

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.64

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.980

Distribution Coefficient, logD

5.980

Water Solubility, LogSw

-5.56

Polar Surface Area

45.321

Acid Dissociation Constant (pKa)

12.63

Base Dissociation Constant (pKb)

5.34

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

32.00

References: we are preparing a list of scientific research reports with Y020-6464 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-6464?
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What is the minimum amount of Y020-6464 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-6464
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-6464
  • 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 Y020-6464 available by request