Y031-7336 Screening compound: N-(4-chlorobenzyl)-1-(2,2-dimethylpropanoyl)-3-piperidinecarboxamide

Y031-7336 Screening compound: N-(4-chlorobenzyl)-1-(2,2-dimethylpropanoyl)-3-piperidinecarboxamide
Y031-7336 Screening compound: N-(4-chlorobenzyl)-1-(2,2-dimethylpropanoyl)-3-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-7336
N-(4-chlorobenzyl)-1-(2,2-dimethylpropanoyl)-3-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

Y031-7336

Molecular Formula

C18H25ClN2O2 (C18 H25 ClN2 O2)

Compound Name

N-(4-chlorobenzyl)-1-(2,2-dimethylpropanoyl)-3-piperidinecarboxamide

IUPAC name

N-[(4-chlorophenyl)methyl]-1-(22-dimethylpropanoyl)piperidine-3-carboxamide

SMILES

CC(C)(C)C(N(CCC1)CC1C(NCc(cc1)ccc1Cl)=O)=O

InChI

InChI=1S/C18H25ClN2O2/c1-18(2,3)17(23)21-10-4-5-14(12-21)16(22)20-11-13-6-8-15(19)9-7-13/h6-9,14H,4-5,10-12H2,1-3H3,(H,20,22)/t14-/m0/s1

InChI Key

IUJHNYFPAQSZHD-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD15178192

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.86

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.846

Distribution Coefficient, logD

2.846

Water Solubility, LogSw

-3.46

Polar Surface Area

41.505

Acid Dissociation Constant (pKa)

12.07

Base Dissociation Constant (pKb)

-0.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.56

Y031-7336 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with Y031-7336 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-7336?
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What is the minimum amount of Y031-7336 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-7336
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-7336
  • 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 Y031-7336 available by request