L533-0772 Screening compound: N-(3,5-dimethylphenyl)-4-(6-phenoxypyrimidin-4-yl)benzamide

L533-0772 Screening compound: N-(3,5-dimethylphenyl)-4-(6-phenoxypyrimidin-4-yl)benzamide
L533-0772 Screening compound: N-(3,5-dimethylphenyl)-4-(6-phenoxypyrimidin-4-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L533-0772
N-(3,5-dimethylphenyl)-4-(6-phenoxypyrimidin-4-yl)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

L533-0772

Molecular Formula

C25H21N3O2 (C25 H21 N3 O2)

Compound Name

N-(3,5-dimethylphenyl)-4-(6-phenoxypyrimidin-4-yl)benzamide

IUPAC name

N-(35-dimethylphenyl)-4-(6-phenoxypyrimidin-4-yl)benzamide

SMILES

Cc1cc(NC(c(cc2)ccc2-c2ncnc(Oc3ccccc3)c2)=O)cc(C)c1

InChI

InChI=1S/C25H21N3O2/c1-17-12-18(2)14-21(13-17)28-25(29)20-10-8-19(9-11-20)23-15-24(27-16-26-23)30-22-6-4-3-5-7-22/h3-16H,1-2H3,(H,28,29)

InChI Key

ASOYMIBMMIJXOV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27460146

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.422

Distribution Coefficient, logD

5.422

Water Solubility, LogSw

-5.49

Polar Surface Area

49.516

Acid Dissociation Constant (pKa)

11.65

Base Dissociation Constant (pKb)

2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

L533-0772 in Drug Discovery

Included in Screening Libraries

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

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with L533-0772 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L533-0772?
Check Price and Availability of L533-0772, 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 L533-0772 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L533-0772
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L533-0772
  • 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 L533-0772 available by request