F943-0090 Screening compound: N-(3-chloro-2-methylphenyl)-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide

F943-0090 Screening compound: N-(3-chloro-2-methylphenyl)-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
F943-0090 Screening compound: N-(3-chloro-2-methylphenyl)-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F943-0090
N-(3-chloro-2-methylphenyl)-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-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

F943-0090

Molecular Formula

C20H20ClN3O4S2 (C20 H20 ClN3 O4 S2)

Compound Name

N-(3-chloro-2-methylphenyl)-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide

IUPAC name

N-(3-chloro-2-methylphenyl)-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-23-dihydro-13-benzothiazole-6-sulfonamide

SMILES

Cc(c(NS(c(cc1)cc(S2)c1N(CC(N1CCCC1)=O)C2=O)(=O)=O)ccc1)c1Cl

InChI

InChI=1S/C20H20ClN3O4S2/c1-13-15(21)5-4-6-16(13)22-30(27,28)14-7-8-17-18(11-14)29-20(26)24(17)12-19(25)23-9-2-3-10-23/h4-8,11,22H,2-3,9-10,12H2,1H3

InChI Key

WTYOQQLOEORIRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27205180

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.98

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.980

Distribution Coefficient, logD

3.753

Water Solubility, LogSw

-4.11

Polar Surface Area

72.522

Acid Dissociation Constant (pKa)

7.56

Base Dissociation Constant (pKb)

-0.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with F943-0090 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F943-0090?
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What is the minimum amount of F943-0090 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F943-0090
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F943-0090
  • 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 F943-0090 available by request