L120-1554 Screening compound: 2-(4-chlorophenyl)-N-(3-cyanophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide

L120-1554 Screening compound: 2-(4-chlorophenyl)-N-(3-cyanophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
L120-1554 Screening compound: 2-(4-chlorophenyl)-N-(3-cyanophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L120-1554
2-(4-chlorophenyl)-N-(3-cyanophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide

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

L120-1554

Molecular Formula

C25H20ClN3O3 (C25 H20 ClN3 O3)

Compound Name

2-(4-chlorophenyl)-N-(3-cyanophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide

IUPAC name

2-(4-chlorophenyl)-N-(3-cyanophenyl)-66-dimethyl-38-dioxo-235678-hexahydroisoquinoline-4-carboxamide

SMILES

CC(C)(CC(C1=CN2c(cc3)ccc3Cl)=C(C(Nc3cc(C#N)ccc3)=O)C2=O)CC1=O

InChI

InChI=1S/C25H20ClN3O3/c1-25(2)11-19-20(21(30)12-25)14-29(18-8-6-16(26)7-9-18)24(32)22(19)23(31)28-17-5-3-4-15(10-17)13-27/h3-10,14H,11-12H2,1-2H3,(H,28,31)

InChI Key

OPQIUGCMZPTGSD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27234002

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.9

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.713

Distribution Coefficient, logD

3.196

Water Solubility, LogSw

-4.31

Polar Surface Area

69.342

Acid Dissociation Constant (pKa)

7.04

Base Dissociation Constant (pKb)

-3.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

L120-1554 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

C-Met Library (15277 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Kinases
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands
  • Receptor's ligands

References: we are preparing a list of scientific research reports with L120-1554 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L120-1554?
Check Price and Availability of L120-1554, 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 L120-1554 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L120-1554
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L120-1554
  • 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 L120-1554 available by request