M121-1745 Screening compound: 1-benzyl-N-[(3-chlorophenyl)methyl]-2-oxo-1,2,3,4-tetrahydroquinoline-6-carboxamide

M121-1745 Screening compound: 1-benzyl-N-[(3-chlorophenyl)methyl]-2-oxo-1,2,3,4-tetrahydroquinoline-6-carboxamide
M121-1745 Screening compound: 1-benzyl-N-[(3-chlorophenyl)methyl]-2-oxo-1,2,3,4-tetrahydroquinoline-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M121-1745
1-benzyl-N-[(3-chlorophenyl)methyl]-2-oxo-1,2,3,4-tetrahydroquinoline-6-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

M121-1745

Molecular Formula

C24H21ClN2O2 (C24 H21 ClN2 O2)

Compound Name

1-benzyl-N-[(3-chlorophenyl)methyl]-2-oxo-1,2,3,4-tetrahydroquinoline-6-carboxamide

IUPAC name

1-benzyl-N-[(3-chlorophenyl)methyl]-2-oxo-1234-tetrahydroquinoline-6-carboxamide

SMILES

O=C(c(cc1)cc(CC2)c1N(Cc1ccccc1)C2=O)NCc1cccc(Cl)c1

InChI

InChI=1S/C24H21ClN2O2/c25-21-8-4-7-18(13-21)15-26-24(29)20-9-11-22-19(14-20)10-12-23(28)27(22)16-17-5-2-1-3-6-17/h1-9,11,13-14H,10,12,15-16H2,(H,26,29)

InChI Key

OSMUXFSTBGWMDJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27498189

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.9

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.134

Distribution Coefficient, logD

5.134

Water Solubility, LogSw

-5.68

Polar Surface Area

40.032

Acid Dissociation Constant (pKa)

10.96

Base Dissociation Constant (pKb)

-3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

M121-1745 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

STING Agonist Library (5895 compounds)

SmartTM Library (51161 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Others
  • Phosphatases

References: we are preparing a list of scientific research reports with M121-1745 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M121-1745?
Check Price and Availability of M121-1745, 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 M121-1745 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M121-1745
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M121-1745
  • 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 M121-1745 available by request