C782-1128 Screening compound: N-[(3-chlorophenyl)methyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

C782-1128 Screening compound: N-[(3-chlorophenyl)methyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide
C782-1128 Screening compound: N-[(3-chlorophenyl)methyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C782-1128
N-[(3-chlorophenyl)methyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

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

C782-1128

Molecular Formula

C22H24ClN3OS (C22 H24 ClN3 OS)

Compound Name

N-[(3-chlorophenyl)methyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

IUPAC name

N-[(3-chlorophenyl)methyl]-1-(46-dimethyl-13-benzothiazol-2-yl)piperidine-4-carboxamide

SMILES

Cc(cc1C)cc2c1nc(N(CC1)CCC1C(NCc1cccc(Cl)c1)=O)s2

InChI

InChI=1S/C22H24ClN3OS/c1-14-10-15(2)20-19(11-14)28-22(25-20)26-8-6-17(7-9-26)21(27)24-13-16-4-3-5-18(23)12-16/h3-5,10-12,17H,6-9,13H2,1-2H3,(H,24,27)

InChI Key

MZSSJVMUTCCZDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14794051

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.97

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.409

Distribution Coefficient, logD

5.407

Water Solubility, LogSw

-5.85

Polar Surface Area

38.410

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

4.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with C782-1128 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C782-1128?
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What is the minimum amount of C782-1128 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C782-1128
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C782-1128
  • 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 C782-1128 available by request