V015-8092 Screening compound: 3-{[2-(4-ethoxyphenyl)-3-oxo-2,3-dihydro-1H-isoindol-1-yl]amino}-N-(1-phenylethyl)benzamide

V015-8092 Screening compound: 3-{[2-(4-ethoxyphenyl)-3-oxo-2,3-dihydro-1H-isoindol-1-yl]amino}-N-(1-phenylethyl)benzamide
V015-8092 Screening compound: 3-{[2-(4-ethoxyphenyl)-3-oxo-2,3-dihydro-1H-isoindol-1-yl]amino}-N-(1-phenylethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-8092
3-{[2-(4-ethoxyphenyl)-3-oxo-2,3-dihydro-1H-isoindol-1-yl]amino}-N-(1-phenylethyl)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

V015-8092

Molecular Formula

C31H29N3O3 (C31 H29 N3 O3)

Compound Name

3-{[2-(4-ethoxyphenyl)-3-oxo-2,3-dihydro-1H-isoindol-1-yl]amino}-N-(1-phenylethyl)benzamide

IUPAC name

3-{[2-(4-ethoxyphenyl)-3-oxo-23-dihydro-1H-isoindol-1-yl]amino}-N-(1-phenylethyl)benzamide

SMILES

CCOc(cc1)ccc1N(C(c1c2cccc1)Nc1cc(C(NC(C)c3ccccc3)=O)ccc1)C2=O

InChI

InChI=1S/C31H29N3O3/c1-3-37-26-18-16-25(17-19-26)34-29(27-14-7-8-15-28(27)31(34)36)33-24-13-9-12-23(20-24)30(35)32-21(2)22-10-5-4-6-11-22/h4-21,29,33H,3H2,1-2H3,(H,32,35)

InChI Key

GVAJACCFTDPLOA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14243456

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.59

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.494

Distribution Coefficient, logD

5.494

Water Solubility, LogSw

-5.52

Polar Surface Area

55.091

Acid Dissociation Constant (pKa)

12.48

Base Dissociation Constant (pKb)

-1.09

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

16.10

V015-8092 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V015-8092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-8092?
Check Price and Availability of V015-8092, 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 V015-8092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-8092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-8092
  • 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 V015-8092 available by request