V013-4158 Screening compound: N~3~-(1-benzyl-4-piperidyl)-1-(2-methoxybenzyl)-5-oxo-3-pyrrolidinecarboxamide

V013-4158 Screening compound: N~3~-(1-benzyl-4-piperidyl)-1-(2-methoxybenzyl)-5-oxo-3-pyrrolidinecarboxamide
V013-4158 Screening compound: N~3~-(1-benzyl-4-piperidyl)-1-(2-methoxybenzyl)-5-oxo-3-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-4158
N~3~-(1-benzyl-4-piperidyl)-1-(2-methoxybenzyl)-5-oxo-3-pyrrolidinecarboxamide

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

V013-4158

Molecular Formula

C25H31N3O3 (C25 H31 N3 O3)

Compound Name

N~3~-(1-benzyl-4-piperidyl)-1-(2-methoxybenzyl)-5-oxo-3-pyrrolidinecarboxamide

IUPAC name

n/a

SMILES

COc1c(CN(CC(C2)C(NC3CCN(Cc4ccccc4)CC3)=O)C2=O)cccc1

InChI

InChI=1S/C25H31N3O3/c1-31-23-10-6-5-9-20(23)17-28-18-21(15-24(28)29)25(30)26-22-11-13-27(14-12-22)16-19-7-3-2-4-8-19/h2-10,21-22H,11-18H2,1H3,(H,26,30)/t21-/m1/s1

InChI Key

KVAOGLDJPZECDX-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD19972102

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.176

Distribution Coefficient, logD

0.618

Water Solubility, LogSw

-2.43

Polar Surface Area

52.744

Acid Dissociation Constant (pKa)

15.06

Base Dissociation Constant (pKb)

8.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.00

V013-4158 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V013-4158 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-4158?
Check Price and Availability of V013-4158, 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 V013-4158 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-4158
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-4158
  • 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 V013-4158 available by request