8015-0893 Screening compound: 2-[4-(2-methylpropyl)phenyl]-N-{4-[(pyridin-4-yl)methyl]phenyl}propanamide

8015-0893 Screening compound: 2-[4-(2-methylpropyl)phenyl]-N-{4-[(pyridin-4-yl)methyl]phenyl}propanamide
8015-0893 Screening compound: 2-[4-(2-methylpropyl)phenyl]-N-{4-[(pyridin-4-yl)methyl]phenyl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-0893
2-[4-(2-methylpropyl)phenyl]-N-{4-[(pyridin-4-yl)methyl]phenyl}propanamide

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

8015-0893

Molecular Formula

C25H28N2O (C25 H28 N2 O)

Compound Name

2-[4-(2-methylpropyl)phenyl]-N-{4-[(pyridin-4-yl)methyl]phenyl}propanamide

IUPAC name

2-[4-(2-methylpropyl)phenyl]-N-{4-[(pyridin-4-yl)methyl]phenyl}propanamide

SMILES

CC(C)Cc1ccc(C(C)C(Nc2ccc(Cc3ccncc3)cc2)=O)cc1

InChI

InChI=1S/C25H28N2O/c1-18(2)16-20-4-8-23(9-5-20)19(3)25(28)27-24-10-6-21(7-11-24)17-22-12-14-26-15-13-22/h4-15,18-19H,16-17H2,1-3H3,(H,27,28)/t19-/m1/s1

InChI Key

RLOSDYPJBDWGEH-LJQANCHMSA-N

MDL Number (MFCD)

MFCD03855391

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.51

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.698

Distribution Coefficient, logD

5.698

Water Solubility, LogSw

-5.30

Polar Surface Area

32.486

Acid Dissociation Constant (pKa)

11.98

Base Dissociation Constant (pKb)

3.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.00

8015-0893 in Drug Discovery

Included in Screening Libraries

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

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with 8015-0893 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-0893?
Check Price and Availability of 8015-0893, 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 8015-0893 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-0893
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-0893
  • 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 8015-0893 available by request