D493-0009 Screening compound: 2-[(1,4-diphenyl-1,6-dihydro-1,3,5-triazin-2-yl)sulfanyl]-1-(piperidin-1-yl)ethan-1-one

D493-0009 Screening compound: 2-[(1,4-diphenyl-1,6-dihydro-1,3,5-triazin-2-yl)sulfanyl]-1-(piperidin-1-yl)ethan-1-one
D493-0009 Screening compound: 2-[(1,4-diphenyl-1,6-dihydro-1,3,5-triazin-2-yl)sulfanyl]-1-(piperidin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D493-0009
2-[(1,4-diphenyl-1,6-dihydro-1,3,5-triazin-2-yl)sulfanyl]-1-(piperidin-1-yl)ethan-1-one

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

D493-0009

Molecular Formula

C22H24N4OS (C22 H24 N4 OS)

Compound Name

2-[(1,4-diphenyl-1,6-dihydro-1,3,5-triazin-2-yl)sulfanyl]-1-(piperidin-1-yl)ethan-1-one

IUPAC name

2-[(14-diphenyl-16-dihydro-135-triazin-2-yl)sulfanyl]-1-(piperidin-1-yl)ethan-1-one

SMILES

O=C(CSC1=NC(c2ccccc2)=NCN1c1ccccc1)N1CCCCC1

InChI

InChI=1S/C22H24N4OS/c27-20(25-14-8-3-9-15-25)16-28-22-24-21(18-10-4-1-5-11-18)23-17-26(22)19-12-6-2-7-13-19/h1-2,4-7,10-13H,3,8-9,14-17H2

InChI Key

OWTJMNKTQPTVQX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12962118

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.373

Distribution Coefficient, logD

-1.448

Water Solubility, LogSw

-4.18

Polar Surface Area

38.373

Acid Dissociation Constant (pKa)

28.03

Base Dissociation Constant (pKb)

13.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

References: we are preparing a list of scientific research reports with D493-0009 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D493-0009?
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What is the minimum amount of D493-0009 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D493-0009
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D493-0009
  • 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 D493-0009 available by request