C066-4151 Screening compound: 1-(3,5-dimethylphenyl)-3-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea

C066-4151 Screening compound: 1-(3,5-dimethylphenyl)-3-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
C066-4151 Screening compound: 1-(3,5-dimethylphenyl)-3-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound C066-4151
1-(3,5-dimethylphenyl)-3-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea

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

C066-4151

Molecular Formula

C19H19N3O2 (C19 H19 N3 O2)

Compound Name

1-(3,5-dimethylphenyl)-3-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea

IUPAC name

1-(35-dimethylphenyl)-3-(2-methyl-1-oxo-12-dihydroisoquinolin-4-yl)urea

SMILES

Cc1cc(NC(NC(c2c3cccc2)=CN(C)C3=O)=O)cc(C)c1

InChI

InChI=1S/C19H19N3O2/c1-12-8-13(2)10-14(9-12)20-19(24)21-17-11-22(3)18(23)16-7-5-4-6-15(16)17/h4-11H,1-3H3,(H2,20,21,24)

InChI Key

UCFYNXXIKHJETO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14715901

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.089

Distribution Coefficient, logD

3.088

Water Solubility, LogSw

-3.54

Polar Surface Area

49.453

Acid Dissociation Constant (pKa)

9.91

Base Dissociation Constant (pKb)

-1.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

C066-4151 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C066-4151 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C066-4151?
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What is the minimum amount of C066-4151 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C066-4151
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C066-4151
  • 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 C066-4151 available by request