F943-0828 Screening compound: N-cyclopentyl-3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide

F943-0828 Screening compound: N-cyclopentyl-3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
F943-0828 Screening compound: N-cyclopentyl-3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F943-0828
N-cyclopentyl-3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide

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

F943-0828

Molecular Formula

C20H27N3O4S2 (C20 H27 N3 O4 S2)

Compound Name

N-cyclopentyl-3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide

IUPAC name

N-cyclopentyl-3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-2-oxo-23-dihydro-13-benzothiazole-6-sulfonamide

SMILES

CC(CC1)CCN1C(CN(c(ccc(S(NC1CCCC1)(=O)=O)c1)c1S1)C1=O)=O

InChI

InChI=1S/C20H27N3O4S2/c1-14-8-10-22(11-9-14)19(24)13-23-17-7-6-16(12-18(17)28-20(23)25)29(26,27)21-15-4-2-3-5-15/h6-7,12,14-15,21H,2-5,8-11,13H2,1H3

InChI Key

HUBPCMXVMQXHAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27205211

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.58

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.373

Distribution Coefficient, logD

3.373

Water Solubility, LogSw

-4.00

Polar Surface Area

74.267

Acid Dissociation Constant (pKa)

11.09

Base Dissociation Constant (pKb)

0.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

F943-0828 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F943-0828 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F943-0828?
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What is the minimum amount of F943-0828 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F943-0828
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F943-0828
  • 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 F943-0828 available by request