L291-0504 Screening compound: N-{1-[3-(dimethylamino)benzoyl]piperidin-4-yl}-4-fluorobenzene-1-sulfonamide

L291-0504 Screening compound: N-{1-[3-(dimethylamino)benzoyl]piperidin-4-yl}-4-fluorobenzene-1-sulfonamide
L291-0504 Screening compound: N-{1-[3-(dimethylamino)benzoyl]piperidin-4-yl}-4-fluorobenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L291-0504
N-{1-[3-(dimethylamino)benzoyl]piperidin-4-yl}-4-fluorobenzene-1-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

L291-0504

Molecular Formula

C20H24FN3O3S (C20 H24 FN3 O3 S)

Compound Name

N-{1-[3-(dimethylamino)benzoyl]piperidin-4-yl}-4-fluorobenzene-1-sulfonamide

IUPAC name

N-{1-[3-(dimethylamino)benzoyl]piperidin-4-yl}-4-fluorobenzene-1-sulfonamide

SMILES

CN(C)c1cccc(C(N(CC2)CCC2NS(c(cc2)ccc2F)(=O)=O)=O)c1

InChI

InChI=1S/C20H24FN3O3S/c1-23(2)18-5-3-4-15(14-18)20(25)24-12-10-17(11-13-24)22-28(26,27)19-8-6-16(21)7-9-19/h3-9,14,17,22H,10-13H2,1-2H3

InChI Key

UKOUWAPIEIKDAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27644573

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.854

Distribution Coefficient, logD

2.854

Water Solubility, LogSw

-3.55

Polar Surface Area

61.196

Acid Dissociation Constant (pKa)

11.28

Base Dissociation Constant (pKb)

2.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

L291-0504 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 L291-0504 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L291-0504?
Check Price and Availability of L291-0504, 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 L291-0504 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L291-0504
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L291-0504
  • 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 L291-0504 available by request