F533-0159 Screening compound: N-(5-chloro-2-methoxyphenyl)-1-{[2,5-dimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carboxamide

F533-0159 Screening compound: N-(5-chloro-2-methoxyphenyl)-1-{[2,5-dimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carboxamide
F533-0159 Screening compound: N-(5-chloro-2-methoxyphenyl)-1-{[2,5-dimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F533-0159
N-(5-chloro-2-methoxyphenyl)-1-{[2,5-dimethyl-4-(pyrrolidine-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

F533-0159

Molecular Formula

C24H31ClN4O5S (C24 H31 ClN4 O5 S)

Compound Name

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

IUPAC name

N-(5-chloro-2-methoxyphenyl)-1-{[25-dimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carboxamide

SMILES

Cc1c(C(N2CCCC2)=O)c(S(N(CC2)CCC2C(Nc(cc(cc2)Cl)c2OC)=O)(=O)=O)c(C)[nH]1

InChI

InChI=1S/C24H31ClN4O5S/c1-15-21(24(31)28-10-4-5-11-28)22(16(2)26-15)35(32,33)29-12-8-17(9-13-29)23(30)27-19-14-18(25)6-7-20(19)34-3/h6-7,14,17,26H,4-5,8-13H2,1-3H3,(H,27,30)

InChI Key

FPLRQIGBVZSWOO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27173260

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

523.05

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.597

Distribution Coefficient, logD

2.578

Water Solubility, LogSw

-3.73

Polar Surface Area

89.775

Acid Dissociation Constant (pKa)

8.75

Base Dissociation Constant (pKb)

2.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

F533-0159 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Targeted Diversity Library (40567 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with F533-0159 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F533-0159?
Check Price and Availability of F533-0159, 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 F533-0159 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F533-0159
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F533-0159
  • 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 F533-0159 available by request