C782-1226 Screening compound: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide

C782-1226 Screening compound: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide
C782-1226 Screening compound: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C782-1226
1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[(4-fluorophenyl)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

C782-1226

Molecular Formula

C22H24FN3OS (C22 H24 FN3 OS)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1C)cc2c1nc(N(CC1)CCC1C(NCc(cc1)ccc1F)=O)s2

InChI

InChI=1S/C22H24FN3OS/c1-14-11-15(2)20-19(12-14)28-22(25-20)26-9-7-17(8-10-26)21(27)24-13-16-3-5-18(23)6-4-16/h3-6,11-12,17H,7-10,13H2,1-2H3,(H,24,27)

InChI Key

UCWLVQZZMLWLRI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14794092

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.52

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

4.741

Distribution Coefficient, logD

4.739

Water Solubility, LogSw

-4.46

Polar Surface Area

38.410

Acid Dissociation Constant (pKa)

12.14

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 C782-1226 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C782-1226?
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What is the minimum amount of C782-1226 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C782-1226
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C782-1226
  • 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 C782-1226 available by request