L120-0834 Screening compound: ethyl 2-[2-(4-fluorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-amido]benzoate

L120-0834 Screening compound: ethyl 2-[2-(4-fluorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-amido]benzoate
L120-0834 Screening compound: ethyl 2-[2-(4-fluorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-amido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound L120-0834
ethyl 2-[2-(4-fluorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-amido]benzoate

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

L120-0834

Molecular Formula

C27H25FN2O5 (C27 H25 FN2 O5)

Compound Name

ethyl 2-[2-(4-fluorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-amido]benzoate

IUPAC name

ethyl 2-[2-(4-fluorophenyl)-66-dimethyl-38-dioxo-235678-hexahydroisoquinoline-4-amido]benzoate

SMILES

CCOC(c(cccc1)c1NC(C1=C(CC(C)(C)CC2=O)C2=CN(c(cc2)ccc2F)C1=O)=O)=O

InChI

InChI=1S/C27H25FN2O5/c1-4-35-26(34)18-7-5-6-8-21(18)29-24(32)23-19-13-27(2,3)14-22(31)20(19)15-30(25(23)33)17-11-9-16(28)10-12-17/h5-12,15H,4,13-14H2,1-3H3,(H,29,32)

InChI Key

WVNCITDSMVYNCC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27233675

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.753

Distribution Coefficient, logD

1.299

Water Solubility, LogSw

-4.13

Polar Surface Area

72.342

Acid Dissociation Constant (pKa)

4.95

Base Dissociation Constant (pKb)

-4.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

L120-0834 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with L120-0834 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L120-0834?
Check Price and Availability of L120-0834, 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 L120-0834 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L120-0834
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L120-0834
  • 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 L120-0834 available by request