J076-0708 Screening compound: 4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)-N-(4-methylpyridin-2-yl)benzamide

J076-0708 Screening compound: 4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)-N-(4-methylpyridin-2-yl)benzamide
J076-0708 Screening compound: 4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)-N-(4-methylpyridin-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J076-0708
4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)-N-(4-methylpyridin-2-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

J076-0708

Molecular Formula

C24H24N4O2 (C24 H24 N4 O2)

Compound Name

4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)-N-(4-methylpyridin-2-yl)benzamide

IUPAC name

4-(3-benzyl-2-oxo-13-diazinan-1-yl)-N-(4-methylpyridin-2-yl)benzamide

SMILES

Cc1cc(NC(c(cc2)ccc2N(CCCN2Cc3ccccc3)C2=O)=O)ncc1

InChI

InChI=1S/C24H24N4O2/c1-18-12-13-25-22(16-18)26-23(29)20-8-10-21(11-9-20)28-15-5-14-27(24(28)30)17-19-6-3-2-4-7-19/h2-4,6-13,16H,5,14-15,17H2,1H3,(H,25,26,29)

InChI Key

DNBHKBLFNXPLKK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27223758

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.942

Distribution Coefficient, logD

3.937

Water Solubility, LogSw

-3.87

Polar Surface Area

52.503

Acid Dissociation Constant (pKa)

9.28

Base Dissociation Constant (pKb)

4.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

J076-0708 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with J076-0708 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J076-0708?
Check Price and Availability of J076-0708, 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 J076-0708 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J076-0708
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J076-0708
  • 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 J076-0708 available by request