Y030-8191 Screening compound: 3-benzamido-N-[2-(propan-2-yl)phenyl]benzamide

Y030-8191 Screening compound: 3-benzamido-N-[2-(propan-2-yl)phenyl]benzamide
Y030-8191 Screening compound: 3-benzamido-N-[2-(propan-2-yl)phenyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-8191
3-benzamido-N-[2-(propan-2-yl)phenyl]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

Y030-8191

Molecular Formula

C23H22N2O2 (C23 H22 N2 O2)

Compound Name

3-benzamido-N-[2-(propan-2-yl)phenyl]benzamide

IUPAC name

3-benzamido-N-[2-(propan-2-yl)phenyl]benzamide

SMILES

CC(C)c(cccc1)c1NC(c1cc(NC(c2ccccc2)=O)ccc1)=O

InChI

InChI=1S/C23H22N2O2/c1-16(2)20-13-6-7-14-21(20)25-23(27)18-11-8-12-19(15-18)24-22(26)17-9-4-3-5-10-17/h3-16H,1-2H3,(H,24,26)(H,25,27)

InChI Key

QRFLUXTTYLSHJK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03639142

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.854

Distribution Coefficient, logD

4.853

Water Solubility, LogSw

-4.58

Polar Surface Area

45.723

Acid Dissociation Constant (pKa)

10.20

Base Dissociation Constant (pKb)

0.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

Y030-8191 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS targets activity set (6557 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 Y030-8191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-8191?
Check Price and Availability of Y030-8191, 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 Y030-8191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-8191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-8191
  • 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 Y030-8191 available by request