E632-0096 Screening compound: N-(4-ethoxyphenyl)-4-[(4-methylpiperidino)methyl]tetrahydro-1(2H)-pyridinecarboxamide

E632-0096 Screening compound: N-(4-ethoxyphenyl)-4-[(4-methylpiperidino)methyl]tetrahydro-1(2H)-pyridinecarboxamide
E632-0096 Screening compound: N-(4-ethoxyphenyl)-4-[(4-methylpiperidino)methyl]tetrahydro-1(2H)-pyridinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E632-0096
N-(4-ethoxyphenyl)-4-[(4-methylpiperidino)methyl]tetrahydro-1(2H)-pyridinecarboxamide

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

E632-0096

Molecular Formula

C21H33N3O2 (C21 H33 N3 O2)

Compound Name

N-(4-ethoxyphenyl)-4-[(4-methylpiperidino)methyl]tetrahydro-1(2H)-pyridinecarboxamide

IUPAC name

n/a

SMILES

CCOc(cc1)ccc1NC(N1CCC(CN2CCC(C)CC2)CC1)=O

InChI

InChI=1S/C21H33N3O2/c1-3-26-20-6-4-19(5-7-20)22-21(25)24-14-10-18(11-15-24)16-23-12-8-17(2)9-13-23/h4-7,17-18H,3,8-16H2,1-2H3,(H,22,25)

InChI Key

QLONHLPNCDIHAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14905559

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.885

Distribution Coefficient, logD

0.944

Water Solubility, LogSw

-3.88

Polar Surface Area

36.564

Acid Dissociation Constant (pKa)

13.70

Base Dissociation Constant (pKb)

10.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.67

E632-0096 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 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 E632-0096 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E632-0096?
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What is the minimum amount of E632-0096 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E632-0096
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E632-0096
  • 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 E632-0096 available by request