8009-7177 Screening compound: (2Z)-N-(4-chlorophenyl)-3-[(4-chlorophenyl)methyl]-4-[4-(piperidine-1-sulfonyl)phenyl]-2,3-dihydro-1,3-thiazol-2-imine

8009-7177 Screening compound: (2Z)-N-(4-chlorophenyl)-3-[(4-chlorophenyl)methyl]-4-[4-(piperidine-1-sulfonyl)phenyl]-2,3-dihydro-1,3-thiazol-2-imine
8009-7177 Screening compound: (2Z)-N-(4-chlorophenyl)-3-[(4-chlorophenyl)methyl]-4-[4-(piperidine-1-sulfonyl)phenyl]-2,3-dihydro-1,3-thiazol-2-imine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-7177
(2Z)-N-(4-chlorophenyl)-3-[(4-chlorophenyl)methyl]-4-[4-(piperidine-1-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

8009-7177

Molecular Formula

C27H25Cl2N3O2S2 (C27 H25 Cl2 N3 O2 S2)

Compound Name

(2Z)-N-(4-chlorophenyl)-3-[(4-chlorophenyl)methyl]-4-[4-(piperidine-1-sulfonyl)phenyl]-2,3-dihydro-1,3-thiazol-2-imine

IUPAC name

(2Z)-N-(4-chlorophenyl)-3-[(4-chlorophenyl)methyl]-4-[4-(piperidine-1-sulfonyl)phenyl]-23-dihydro-13-thiazol-2-imine

SMILES

O=S(c(cc1)ccc1C(N1Cc(cc2)ccc2Cl)=CS/C1=N\c(cc1)ccc1Cl)(N1CCCCC1)=O

InChI

InChI=1S/C27H25Cl2N3O2S2/c28-22-8-4-20(5-9-22)18-32-26(19-35-27(32)30-24-12-10-23(29)11-13-24)21-6-14-25(15-7-21)36(33,34)31-16-2-1-3-17-31/h4-15,19H,1-3,16-18H2

InChI Key

JJZCXZDHPMWTDF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01819866

Chemical and Physical Properties

Saltdata

HBr

Molecular Weight

558.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.379

Distribution Coefficient, logD

7.379

Water Solubility, LogSw

-6.90

Polar Surface Area

43.014

Acid Dissociation Constant (pKa)

28.03

Base Dissociation Constant (pKb)

3.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with 8009-7177 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-7177?
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What is the minimum amount of 8009-7177 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-7177
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-7177
  • 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 8009-7177 available by request