C154-0173 Screening compound: N-(5-chloro-2,4-dimethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide

C154-0173 Screening compound: N-(5-chloro-2,4-dimethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
C154-0173 Screening compound: N-(5-chloro-2,4-dimethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C154-0173
N-(5-chloro-2,4-dimethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2-dihydroisoquinoline-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

C154-0173

Molecular Formula

C21H21ClN2O6 (C21 H21 ClN2 O6)

Compound Name

N-(5-chloro-2,4-dimethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide

IUPAC name

N-(5-chloro-24-dimethoxyphenyl)-67-dimethoxy-2-methyl-1-oxo-12-dihydroisoquinoline-4-carboxamide

SMILES

CN(C=C(C(Nc(c(OC)c1)cc(Cl)c1OC)=O)c(cc1OC)c2cc1OC)C2=O

InChI

InChI=1S/C21H21ClN2O6/c1-24-10-13(11-6-18(29-4)19(30-5)7-12(11)21(24)26)20(25)23-15-8-14(22)16(27-2)9-17(15)28-3/h6-10H,1-5H3,(H,23,25)

InChI Key

BEZMOPVXFBBWTJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14723224

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.86

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.696

Distribution Coefficient, logD

1.720

Water Solubility, LogSw

-3.52

Polar Surface Area

69.102

Acid Dissociation Constant (pKa)

6.47

Base Dissociation Constant (pKb)

2.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

C154-0173 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anticancer Library (62698 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C154-0173 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C154-0173?
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What is the minimum amount of C154-0173 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C154-0173
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C154-0173
  • 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 C154-0173 available by request