C858-0843 Screening compound: 6-(4-methylpiperidine-1-carbonyl)-2-(piperidin-1-yl)-1,3-benzothiazole

C858-0843 Screening compound: 6-(4-methylpiperidine-1-carbonyl)-2-(piperidin-1-yl)-1,3-benzothiazole
C858-0843 Screening compound: 6-(4-methylpiperidine-1-carbonyl)-2-(piperidin-1-yl)-1,3-benzothiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound C858-0843
6-(4-methylpiperidine-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

C858-0843

Molecular Formula

C19H25N3OS (C19 H25 N3 OS)

Compound Name

6-(4-methylpiperidine-1-carbonyl)-2-(piperidin-1-yl)-1,3-benzothiazole

IUPAC name

6-(4-methylpiperidine-1-carbonyl)-2-(piperidin-1-yl)-13-benzothiazole

SMILES

CC(CC1)CCN1C(c(cc1)cc2c1nc(N1CCCCC1)s2)=O

InChI

InChI=1S/C19H25N3OS/c1-14-7-11-21(12-8-14)18(23)15-5-6-16-17(13-15)24-19(20-16)22-9-3-2-4-10-22/h5-6,13-14H,2-4,7-12H2,1H3

InChI Key

AFMTUACSTHTEQO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14801344

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.49

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.106

Distribution Coefficient, logD

4.105

Water Solubility, LogSw

-4.15

Polar Surface Area

29.875

Acid Dissociation Constant (pKa)

23.10

Base Dissociation Constant (pKb)

4.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.90

C858-0843 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C858-0843 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C858-0843?
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What is the minimum amount of C858-0843 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C858-0843
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C858-0843
  • 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 C858-0843 available by request