C782-1188 Screening compound: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide

C782-1188 Screening compound: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide
C782-1188 Screening compound: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C782-1188
1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[(4-methylphenyl)methyl]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

C782-1188

Molecular Formula

C23H27N3OS (C23 H27 N3 OS)

Compound Name

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

IUPAC name

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

SMILES

Cc1ccc(CNC(C(CC2)CCN2c2nc(c(C)cc(C)c3)c3s2)=O)cc1

InChI

InChI=1S/C23H27N3OS/c1-15-4-6-18(7-5-15)14-24-22(27)19-8-10-26(11-9-19)23-25-21-17(3)12-16(2)13-20(21)28-23/h4-7,12-13,19H,8-11,14H2,1-3H3,(H,24,27)

InChI Key

NUMIEUQEYGQDRD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14794069

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.55

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

5.135

Distribution Coefficient, logD

5.133

Water Solubility, LogSw

-4.90

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

39.10

C782-1188 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C782-1188 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C782-1188?
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What is the minimum amount of C782-1188 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C782-1188
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C782-1188
  • 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 C782-1188 available by request