F533-0553 Screening compound: N-(3-chloro-4-fluorophenyl)-1-{[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carboxamide

F533-0553 Screening compound: N-(3-chloro-4-fluorophenyl)-1-{[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carboxamide
F533-0553 Screening compound: N-(3-chloro-4-fluorophenyl)-1-{[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F533-0553
N-(3-chloro-4-fluorophenyl)-1-{[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carboxamide

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

F533-0553

Molecular Formula

C24H30ClFN4O4S (C24 H30 ClFN4 O4 S)

Compound Name

N-(3-chloro-4-fluorophenyl)-1-{[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carboxamide

IUPAC name

N-(3-chloro-4-fluorophenyl)-1-{[25-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carboxamide

SMILES

Cc1c(C(N2CCCCC2)=O)c(S(N(CC2)CCC2C(Nc(cc2)cc(Cl)c2F)=O)(=O)=O)c(C)[nH]1

InChI

InChI=1S/C24H30ClFN4O4S/c1-15-21(24(32)29-10-4-3-5-11-29)22(16(2)27-15)35(33,34)30-12-8-17(9-13-30)23(31)28-18-6-7-20(26)19(25)14-18/h6-7,14,17,27H,3-5,8-13H2,1-2H3,(H,28,31)

InChI Key

PPTVGPAJKHDQHR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27173336

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

525.04

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.063

Distribution Coefficient, logD

3.021

Water Solubility, LogSw

-3.79

Polar Surface Area

82.477

Acid Dissociation Constant (pKa)

8.40

Base Dissociation Constant (pKb)

2.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

F533-0553 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with F533-0553 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F533-0553?
Check Price and Availability of F533-0553, 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 F533-0553 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F533-0553
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F533-0553
  • 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 F533-0553 available by request