F943-1226 Screening compound: N-(2,3-dimethylphenyl)-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide

F943-1226 Screening compound: N-(2,3-dimethylphenyl)-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
F943-1226 Screening compound: N-(2,3-dimethylphenyl)-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F943-1226
N-(2,3-dimethylphenyl)-3-[2-(morpholin-4-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

F943-1226

Molecular Formula

C21H23N3O5S2 (C21 H23 N3 O5 S2)

Compound Name

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

IUPAC name

N-(23-dimethylphenyl)-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-23-dihydro-13-benzothiazole-6-sulfonamide

SMILES

Cc1cccc(NS(c(cc2)cc(S3)c2N(CC(N2CCOCC2)=O)C3=O)(=O)=O)c1C

InChI

InChI=1S/C21H23N3O5S2/c1-14-4-3-5-17(15(14)2)22-31(27,28)16-6-7-18-19(12-16)30-21(26)24(18)13-20(25)23-8-10-29-11-9-23/h3-7,12,22H,8-11,13H2,1-2H3

InChI Key

UERZBOCKPYAEMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27205240

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.56

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.864

Distribution Coefficient, logD

2.861

Water Solubility, LogSw

-3.43

Polar Surface Area

80.064

Acid Dissociation Constant (pKa)

9.62

Base Dissociation Constant (pKb)

-0.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

F943-1226 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 F943-1226 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F943-1226?
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What is the minimum amount of F943-1226 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F943-1226
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F943-1226
  • 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 F943-1226 available by request