L517-0132 Screening compound: N1-(4-bromo-2-fluorophenyl)-N4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine-1,4-dicarboxamide

L517-0132 Screening compound: N1-(4-bromo-2-fluorophenyl)-N4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine-1,4-dicarboxamide
L517-0132 Screening compound: N1-(4-bromo-2-fluorophenyl)-N4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine-1,4-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L517-0132
N1-(4-bromo-2-fluorophenyl)-N4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine-1,4-dicarboxamide

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

L517-0132

Molecular Formula

C18H20BrFN4O2S (C18 H20 BrFN4 O2 S)

Compound Name

N1-(4-bromo-2-fluorophenyl)-N4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine-1,4-dicarboxamide

IUPAC name

N1-(4-bromo-2-fluorophenyl)-N4-[(2-methyl-13-thiazol-4-yl)methyl]piperidine-14-dicarboxamide

SMILES

Cc1nc(CNC(C(CC2)CCN2C(Nc(ccc(Br)c2)c2F)=O)=O)cs1

InChI

InChI=1S/C18H20BrFN4O2S/c1-11-22-14(10-27-11)9-21-17(25)12-4-6-24(7-5-12)18(26)23-16-3-2-13(19)8-15(16)20/h2-3,8,10,12H,4-7,9H2,1H3,(H,21,25)(H,23,26)

InChI Key

ZFFGOEAWISCQHO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15129164

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.225

Distribution Coefficient, logD

3.224

Water Solubility, LogSw

-3.35

Polar Surface Area

59.730

Acid Dissociation Constant (pKa)

10.34

Base Dissociation Constant (pKb)

1.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

L517-0132 in Drug Discovery

Included in Screening Libraries

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

Macl-GPIb alpha Interaction Library (22969 compounds)

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
Agro:
  • Agro

References: we are preparing a list of scientific research reports with L517-0132 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L517-0132?
Check Price and Availability of L517-0132, 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 L517-0132 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L517-0132
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L517-0132
  • 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 L517-0132 available by request