V015-1052 Screening compound: 2-(4-benzylpiperidin-1-yl)-5-{[(3-chloro-4-methylphenyl)carbamoyl]amino}-N-[(oxolan-2-yl)methyl]benzamide

V015-1052 Screening compound: 2-(4-benzylpiperidin-1-yl)-5-{[(3-chloro-4-methylphenyl)carbamoyl]amino}-N-[(oxolan-2-yl)methyl]benzamide
V015-1052 Screening compound: 2-(4-benzylpiperidin-1-yl)-5-{[(3-chloro-4-methylphenyl)carbamoyl]amino}-N-[(oxolan-2-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-1052
2-(4-benzylpiperidin-1-yl)-5-{[(3-chloro-4-methylphenyl)carbamoyl]amino}-N-[(oxolan-2-yl)methyl]benzamide

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

V015-1052

Molecular Formula

C32H37ClN4O3 (C32 H37 ClN4 O3)

Compound Name

2-(4-benzylpiperidin-1-yl)-5-{[(3-chloro-4-methylphenyl)carbamoyl]amino}-N-[(oxolan-2-yl)methyl]benzamide

IUPAC name

2-(4-benzylpiperidin-1-yl)-5-{[(3-chloro-4-methylphenyl)carbamoyl]amino}-N-[(oxolan-2-yl)methyl]benzamide

SMILES

Cc(ccc(NC(Nc(cc1)cc(C(NCC2OCCC2)=O)c1N1CCC(Cc2ccccc2)CC1)=O)c1)c1Cl

InChI

InChI=1S/C32H37ClN4O3/c1-22-9-10-26(20-29(22)33)36-32(39)35-25-11-12-30(28(19-25)31(38)34-21-27-8-5-17-40-27)37-15-13-24(14-16-37)18-23-6-3-2-4-7-23/h2-4,6-7,9-12,19-20,24,27H,5,8,13-18,21H2,1H3,(H,34,38)(H2,35,36,39)/t27-/m1/s1

InChI Key

JMUPOBZNTNJUMZ-HHHXNRCGSA-N

MDL Number (MFCD)

MFCD14241776

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

561.12

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

7.621

Distribution Coefficient, logD

7.621

Water Solubility, LogSw

-6.30

Polar Surface Area

68.489

Acid Dissociation Constant (pKa)

11.50

Base Dissociation Constant (pKb)

4.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

V015-1052 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V015-1052 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-1052?
Check Price and Availability of V015-1052, 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 V015-1052 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-1052
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-1052
  • 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 V015-1052 available by request