0917-0020 Screening compound: 3-(diethylsulfamoyl)-N-(4-fluorophenyl)-4-methylbenzamide

0917-0020 Screening compound: 3-(diethylsulfamoyl)-N-(4-fluorophenyl)-4-methylbenzamide
0917-0020 Screening compound: 3-(diethylsulfamoyl)-N-(4-fluorophenyl)-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0917-0020
3-(diethylsulfamoyl)-N-(4-fluorophenyl)-4-methylbenzamide

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

0917-0020

Molecular Formula

C18H21FN2O3S (C18 H21 FN2 O3 S)

Compound Name

3-(diethylsulfamoyl)-N-(4-fluorophenyl)-4-methylbenzamide

IUPAC name

3-(diethylsulfamoyl)-N-(4-fluorophenyl)-4-methylbenzamide

SMILES

CCN(CC)S(c1c(C)ccc(C(Nc(cc2)ccc2F)=O)c1)(=O)=O

InChI

InChI=1S/C18H21FN2O3S/c1-4-21(5-2)25(23,24)17-12-14(7-6-13(17)3)18(22)20-16-10-8-15(19)9-11-16/h6-12H,4-5H2,1-3H3,(H,20,22)

InChI Key

BRJRUKSCVTZAJW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00658129

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.495

Distribution Coefficient, logD

3.472

Water Solubility, LogSw

-3.79

Polar Surface Area

54.426

Acid Dissociation Constant (pKa)

8.65

Base Dissociation Constant (pKb)

-3.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

0917-0020 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 0917-0020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0917-0020?
Check Price and Availability of 0917-0020, 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 0917-0020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0917-0020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0917-0020
  • 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 0917-0020 available by request