C858-0850 Screening compound: 6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-2-(piperidin-1-yl)-1,3-benzothiazole

C858-0850 Screening compound: 6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-2-(piperidin-1-yl)-1,3-benzothiazole
C858-0850 Screening compound: 6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-2-(piperidin-1-yl)-1,3-benzothiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound C858-0850
6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-2-(piperidin-1-yl)-1,3-benzothiazole

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

C858-0850

Molecular Formula

C24H27ClN4OS (C24 H27 ClN4 OS)

Compound Name

6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-2-(piperidin-1-yl)-1,3-benzothiazole

IUPAC name

6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-2-(piperidin-1-yl)-13-benzothiazole

SMILES

Cc(ccc(Cl)c1)c1N(CC1)CCN1C(c(cc1)cc2c1nc(N1CCCCC1)s2)=O

InChI

InChI=1S/C24H27ClN4OS/c1-17-5-7-19(25)16-21(17)27-11-13-28(14-12-27)23(30)18-6-8-20-22(15-18)31-24(26-20)29-9-3-2-4-10-29/h5-8,15-16H,2-4,9-14H2,1H3

InChI Key

QFUCSCKKXBFXOR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14801348

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.02

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.694

Distribution Coefficient, logD

5.693

Water Solubility, LogSw

-5.91

Polar Surface Area

32.834

Acid Dissociation Constant (pKa)

23.10

Base Dissociation Constant (pKb)

4.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

References: we are preparing a list of scientific research reports with C858-0850 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C858-0850?
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What is the minimum amount of C858-0850 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C858-0850
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C858-0850
  • 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 C858-0850 available by request