C155-0645 Screening compound: 1-[1-(4-tert-butylbenzenesulfonyl)piperidine-2-carbonyl]-4-(2-fluorophenyl)piperazine

C155-0645 Screening compound: 1-[1-(4-tert-butylbenzenesulfonyl)piperidine-2-carbonyl]-4-(2-fluorophenyl)piperazine
C155-0645 Screening compound: 1-[1-(4-tert-butylbenzenesulfonyl)piperidine-2-carbonyl]-4-(2-fluorophenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C155-0645
1-[1-(4-tert-butylbenzenesulfonyl)piperidine-2-carbonyl]-4-(2-fluorophenyl)piperazine

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

C155-0645

Molecular Formula

C26H34FN3O3S (C26 H34 FN3 O3 S)

Compound Name

1-[1-(4-tert-butylbenzenesulfonyl)piperidine-2-carbonyl]-4-(2-fluorophenyl)piperazine

IUPAC name

1-[1-(4-tert-butylbenzenesulfonyl)piperidine-2-carbonyl]-4-(2-fluorophenyl)piperazine

SMILES

CC(C)(C)c(cc1)ccc1S(N(CCCC1)C1C(N(CC1)CCN1c(cccc1)c1F)=O)(=O)=O

InChI

InChI=1S/C26H34FN3O3S/c1-26(2,3)20-11-13-21(14-12-20)34(32,33)30-15-7-6-10-24(30)25(31)29-18-16-28(17-19-29)23-9-5-4-8-22(23)27/h4-5,8-9,11-14,24H,6-7,10,15-19H2,1-3H3/t24-/m0/s1

InChI Key

HICIZZSQBYVESN-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD14723330

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.64

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.112

Distribution Coefficient, logD

5.112

Water Solubility, LogSw

-4.94

Polar Surface Area

52.028

Acid Dissociation Constant (pKa)

20.72

Base Dissociation Constant (pKb)

2.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

C155-0645 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Anti-HIV1 Library (19540 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C155-0645 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C155-0645?
Check Price and Availability of C155-0645, 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 C155-0645 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C155-0645
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C155-0645
  • 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 C155-0645 available by request