C224-1701 Screening compound: N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-1-(thiophene-2-sulfonyl)piperidine-4-carboxamide

C224-1701 Screening compound: N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-1-(thiophene-2-sulfonyl)piperidine-4-carboxamide
C224-1701 Screening compound: N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-1-(thiophene-2-sulfonyl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C224-1701
N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-1-(thiophene-2-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

C224-1701

Molecular Formula

C23H31FN4O3S2 (C23 H31 FN4 O3 S2)

Compound Name

N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-1-(thiophene-2-sulfonyl)piperidine-4-carboxamide

IUPAC name

N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-1-(thiophene-2-sulfonyl)piperidine-4-carboxamide

SMILES

O=C(C(CC1)CCN1S(c1cccs1)(=O)=O)NCCCN(CC1)CCN1c(cccc1)c1F

InChI

InChI=1S/C23H31FN4O3S2/c24-20-5-1-2-6-21(20)27-16-14-26(15-17-27)11-4-10-25-23(29)19-8-12-28(13-9-19)33(30,31)22-7-3-18-32-22/h1-3,5-7,18-19H,4,8-17H2,(H,25,29)

InChI Key

MTQKPMMAHWAHJB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14732659

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.65

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.386

Distribution Coefficient, logD

2.055

Water Solubility, LogSw

-2.74

Polar Surface Area

64.165

Acid Dissociation Constant (pKa)

15.07

Base Dissociation Constant (pKb)

7.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.20

C224-1701 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Human GPCR Annotated Library (5539 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C224-1701 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C224-1701?
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What is the minimum amount of C224-1701 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C224-1701
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C224-1701
  • 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 C224-1701 available by request