L367-0696 Screening compound: 4-[2-(benzylamino)pyrimidin-5-yl]-N-[(3,4-diethoxyphenyl)methyl]benzamide

L367-0696 Screening compound: 4-[2-(benzylamino)pyrimidin-5-yl]-N-[(3,4-diethoxyphenyl)methyl]benzamide
L367-0696 Screening compound: 4-[2-(benzylamino)pyrimidin-5-yl]-N-[(3,4-diethoxyphenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L367-0696
4-[2-(benzylamino)pyrimidin-5-yl]-N-[(3,4-diethoxyphenyl)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

L367-0696

Molecular Formula

C29H30N4O3 (C29 H30 N4 O3)

Compound Name

4-[2-(benzylamino)pyrimidin-5-yl]-N-[(3,4-diethoxyphenyl)methyl]benzamide

IUPAC name

4-[2-(benzylamino)pyrimidin-5-yl]-N-[(34-diethoxyphenyl)methyl]benzamide

SMILES

CCOc(ccc(CNC(c(cc1)ccc1-c1cnc(NCc2ccccc2)nc1)=O)c1)c1OCC

InChI

InChI=1S/C29H30N4O3/c1-3-35-26-15-10-22(16-27(26)36-4-2)18-30-28(34)24-13-11-23(12-14-24)25-19-32-29(33-20-25)31-17-21-8-6-5-7-9-21/h5-16,19-20H,3-4,17-18H2,1-2H3,(H,30,34)(H,31,32,33)

InChI Key

JLFZCLWSUSEKPU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27248130

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.039

Distribution Coefficient, logD

4.039

Water Solubility, LogSw

-4.09

Polar Surface Area

69.784

Acid Dissociation Constant (pKa)

13.29

Base Dissociation Constant (pKb)

2.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.70

L367-0696 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Antibacterial Compounds Library (13827 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • Epigenetic
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with L367-0696 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L367-0696?
Check Price and Availability of L367-0696, 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 L367-0696 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L367-0696
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L367-0696
  • 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 L367-0696 available by request