L723-0028 Screening compound: 3-(2-benzyl-2,3-dihydro-1H-isoindol-5-yl)-1-(2-bromophenyl)urea

L723-0028 Screening compound: 3-(2-benzyl-2,3-dihydro-1H-isoindol-5-yl)-1-(2-bromophenyl)urea
L723-0028 Screening compound: 3-(2-benzyl-2,3-dihydro-1H-isoindol-5-yl)-1-(2-bromophenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L723-0028
3-(2-benzyl-2,3-dihydro-1H-isoindol-5-yl)-1-(2-bromophenyl)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

L723-0028

Molecular Formula

C22H20BrN3O (C22 H20 BrN3 O)

Compound Name

3-(2-benzyl-2,3-dihydro-1H-isoindol-5-yl)-1-(2-bromophenyl)urea

IUPAC name

3-(2-benzyl-23-dihydro-1H-isoindol-5-yl)-1-(2-bromophenyl)urea

SMILES

O=C(Nc1cc(CN(Cc2ccccc2)C2)c2cc1)Nc(cccc1)c1Br

InChI

InChI=1S/C22H20BrN3O/c23-20-8-4-5-9-21(20)25-22(27)24-19-11-10-17-14-26(15-18(17)12-19)13-16-6-2-1-3-7-16/h1-12H,13-15H2,(H2,24,25,27)

InChI Key

NBSWIWSEMLMCPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15134054

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.32

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.093

Distribution Coefficient, logD

0.371

Water Solubility, LogSw

-5.21

Polar Surface Area

35.537

Acid Dissociation Constant (pKa)

12.79

Base Dissociation Constant (pKb)

11.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

L723-0028 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with L723-0028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L723-0028?
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What is the minimum amount of L723-0028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L723-0028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L723-0028
  • 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 L723-0028 available by request