F398-0453 Screening compound: 4-cyclohexylphenyl [2-phenyl-6,7-dihydro[1,3]thiazolo[5,4-c]pyridin-5(4H)-yl] sulfone

F398-0453 Screening compound: 4-cyclohexylphenyl [2-phenyl-6,7-dihydro[1,3]thiazolo[5,4-c]pyridin-5(4H)-yl] sulfone
F398-0453 Screening compound: 4-cyclohexylphenyl [2-phenyl-6,7-dihydro[1,3]thiazolo[5,4-c]pyridin-5(4H)-yl] sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound F398-0453
4-cyclohexylphenyl [2-phenyl-6,7-dihydro[1,3]thiazolo[5,4-c]pyridin-5(4H)-yl] sulfone

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

F398-0453

Molecular Formula

C24H26N2O2S2 (C24 H26 N2 O2 S2)

Compound Name

4-cyclohexylphenyl [2-phenyl-6,7-dihydro[1,3]thiazolo[5,4-c]pyridin-5(4H)-yl] sulfone

IUPAC name

5-(4-cyclohexylbenzenesulfonyl)-2-phenyl-4H5H6H7H-[13]thiazolo[54-c]pyridine

SMILES

O=S(c1ccc(C2CCCCC2)cc1)(N(CC1)Cc2c1nc(-c1ccccc1)s2)=O

InChI

InChI=1S/C24H26N2O2S2/c27-30(28,21-13-11-19(12-14-21)18-7-3-1-4-8-18)26-16-15-22-23(17-26)29-24(25-22)20-9-5-2-6-10-20/h2,5-6,9-14,18H,1,3-4,7-8,15-17H2

InChI Key

XULAVMLLCLWBAT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27123446

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.61

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.667

Distribution Coefficient, logD

6.667

Water Solubility, LogSw

-6.11

Polar Surface Area

42.767

Acid Dissociation Constant (pKa)

24.51

Base Dissociation Constant (pKb)

0.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with F398-0453 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F398-0453?
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What is the minimum amount of F398-0453 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F398-0453
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F398-0453
  • 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 F398-0453 available by request