E942-0237 Screening compound: 1-[2-(4-methylphenyl)ethyl]-3-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea

E942-0237 Screening compound: 1-[2-(4-methylphenyl)ethyl]-3-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
E942-0237 Screening compound: 1-[2-(4-methylphenyl)ethyl]-3-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound E942-0237
1-[2-(4-methylphenyl)ethyl]-3-[2-(2-methylpropyl)-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

E942-0237

Molecular Formula

C23H27N3O2 (C23 H27 N3 O2)

Compound Name

1-[2-(4-methylphenyl)ethyl]-3-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea

IUPAC name

1-[2-(4-methylphenyl)ethyl]-3-[2-(2-methylpropyl)-1-oxo-12-dihydroisoquinolin-4-yl]urea

SMILES

CC(C)CN(C=C(c1c2cccc1)NC(NCCc1ccc(C)cc1)=O)C2=O

InChI

InChI=1S/C23H27N3O2/c1-16(2)14-26-15-21(19-6-4-5-7-20(19)22(26)27)25-23(28)24-13-12-18-10-8-17(3)9-11-18/h4-11,15-16H,12-14H2,1-3H3,(H2,24,25,28)

InChI Key

ZTVOHANRALZPPO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14928958

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.771

Distribution Coefficient, logD

3.709

Water Solubility, LogSw

-3.98

Polar Surface Area

50.902

Acid Dissociation Constant (pKa)

8.22

Base Dissociation Constant (pKb)

0.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with E942-0237 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E942-0237?
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What is the minimum amount of E942-0237 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E942-0237
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E942-0237
  • 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 E942-0237 available by request