8008-9447 Screening compound: (2Z)-3-benzyl-N-(4-fluorophenyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-2,3-dihydro-1,3-thiazol-2-imine

8008-9447 Screening compound: (2Z)-3-benzyl-N-(4-fluorophenyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-2,3-dihydro-1,3-thiazol-2-imine
8008-9447 Screening compound: (2Z)-3-benzyl-N-(4-fluorophenyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-2,3-dihydro-1,3-thiazol-2-imine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-9447
(2Z)-3-benzyl-N-(4-fluorophenyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-2,3-dihydro-1,3-thiazol-2-imine

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

8008-9447

Molecular Formula

C26H24FN3O3S2 (C26 H24 FN3 O3 S2)

Compound Name

(2Z)-3-benzyl-N-(4-fluorophenyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-2,3-dihydro-1,3-thiazol-2-imine

IUPAC name

(2Z)-3-benzyl-N-(4-fluorophenyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-23-dihydro-13-thiazol-2-imine

SMILES

O=S(c(cc1)ccc1C(N1Cc2ccccc2)=CS/C1=N\c(cc1)ccc1F)(N1CCOCC1)=O

InChI

InChI=1S/C26H24FN3O3S2/c27-22-8-10-23(11-9-22)28-26-30(18-20-4-2-1-3-5-20)25(19-34-26)21-6-12-24(13-7-21)35(31,32)29-14-16-33-17-15-29/h1-13,19H,14-18H2

InChI Key

SYFXEYFMYWVVEI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01460522

Chemical and Physical Properties

Saltdata

HBr

Molecular Weight

509.63

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.229

Distribution Coefficient, logD

5.229

Water Solubility, LogSw

-5.54

Polar Surface Area

50.923

Acid Dissociation Constant (pKa)

28.41

Base Dissociation Constant (pKb)

3.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

References: we are preparing a list of scientific research reports with 8008-9447 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-9447?
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What is the minimum amount of 8008-9447 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-9447
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-9447
  • 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 8008-9447 available by request