L442-0168 Screening compound: 1-[4-(benzoylamino)benzoyl]-N-cyclopentyl-4-piperidinecarboxamide

L442-0168 Screening compound: 1-[4-(benzoylamino)benzoyl]-N-cyclopentyl-4-piperidinecarboxamide
L442-0168 Screening compound: 1-[4-(benzoylamino)benzoyl]-N-cyclopentyl-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L442-0168
1-[4-(benzoylamino)benzoyl]-N-cyclopentyl-4-piperidinecarboxamide

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

L442-0168

Molecular Formula

C25H29N3O3 (C25 H29 N3 O3)

Compound Name

1-[4-(benzoylamino)benzoyl]-N-cyclopentyl-4-piperidinecarboxamide

IUPAC name

1-(4-benzamidobenzoyl)-N-cyclopentylpiperidine-4-carboxamide

SMILES

O=C(C(CC1)CCN1C(c(cc1)ccc1NC(c1ccccc1)=O)=O)NC1CCCC1

InChI

InChI=1S/C25H29N3O3/c29-23(18-6-2-1-3-7-18)27-22-12-10-20(11-13-22)25(31)28-16-14-19(15-17-28)24(30)26-21-8-4-5-9-21/h1-3,6-7,10-13,19,21H,4-5,8-9,14-17H2,(H,26,30)(H,27,29)

InChI Key

QZZZQASXYLGYJV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15127542

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

419.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.828

Distribution Coefficient, logD

2.817

Water Solubility, LogSw

-3.43

Polar Surface Area

64.483

Acid Dissociation Constant (pKa)

9.02

Base Dissociation Constant (pKb)

1.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

L442-0168 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with L442-0168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L442-0168?
Check Price and Availability of L442-0168, 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 L442-0168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L442-0168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L442-0168
  • 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 L442-0168 available by request