F952-0167 Screening compound: N-(3,4-difluorophenyl)-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide

F952-0167 Screening compound: N-(3,4-difluorophenyl)-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
F952-0167 Screening compound: N-(3,4-difluorophenyl)-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F952-0167
N-(3,4-difluorophenyl)-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-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

F952-0167

Molecular Formula

C20H19F2N3O4S2 (C20 H19 F2 N3 O4 S2)

Compound Name

N-(3,4-difluorophenyl)-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide

IUPAC name

N-(34-difluorophenyl)-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-23-dihydro-13-benzothiazole-6-sulfonamide

SMILES

O=C(CCN(c(ccc(S(Nc(cc1)cc(F)c1F)(=O)=O)c1)c1S1)C1=O)N1CCCC1

InChI

InChI=1S/C20H19F2N3O4S2/c21-15-5-3-13(11-16(15)22)23-31(28,29)14-4-6-17-18(12-14)30-20(27)25(17)10-7-19(26)24-8-1-2-9-24/h3-6,11-12,23H,1-2,7-10H2

InChI Key

NEFDOPJUXZIODM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27205817

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.671

Distribution Coefficient, logD

2.258

Water Solubility, LogSw

-4.11

Polar Surface Area

73.198

Acid Dissociation Constant (pKa)

6.00

Base Dissociation Constant (pKb)

-2.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with F952-0167 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F952-0167?
Check Price and Availability of F952-0167, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F952-0167 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F952-0167
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F952-0167
  • 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 F952-0167 available by request