L057-0651 Screening compound: 3-[(1-benzoyl-2-methyl-2,3-dihydro-1H-indol-6-yl)methyl]-1-(3-chloro-4-methylphenyl)urea

L057-0651 Screening compound: 3-[(1-benzoyl-2-methyl-2,3-dihydro-1H-indol-6-yl)methyl]-1-(3-chloro-4-methylphenyl)urea
L057-0651 Screening compound: 3-[(1-benzoyl-2-methyl-2,3-dihydro-1H-indol-6-yl)methyl]-1-(3-chloro-4-methylphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L057-0651
3-[(1-benzoyl-2-methyl-2,3-dihydro-1H-indol-6-yl)methyl]-1-(3-chloro-4-methylphenyl)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

L057-0651

Molecular Formula

C25H24ClN3O2 (C25 H24 ClN3 O2)

Compound Name

3-[(1-benzoyl-2-methyl-2,3-dihydro-1H-indol-6-yl)methyl]-1-(3-chloro-4-methylphenyl)urea

IUPAC name

3-[(1-benzoyl-2-methyl-23-dihydro-1H-indol-6-yl)methyl]-1-(3-chloro-4-methylphenyl)urea

SMILES

CC(C1)N(C(c2ccccc2)=O)c2c1ccc(CNC(Nc1cc(Cl)c(C)cc1)=O)c2

InChI

InChI=1S/C25H24ClN3O2/c1-16-8-11-21(14-22(16)26)28-25(31)27-15-18-9-10-20-12-17(2)29(23(20)13-18)24(30)19-6-4-3-5-7-19/h3-11,13-14,17H,12,15H2,1-2H3,(H2,27,28,31)/t17-/m1/s1

InChI Key

KEIVVQBCXTYXII-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD27227115

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.94

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.454

Distribution Coefficient, logD

5.454

Water Solubility, LogSw

-5.91

Polar Surface Area

48.481

Acid Dissociation Constant (pKa)

12.06

Base Dissociation Constant (pKb)

-0.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

L057-0651 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L057-0651 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L057-0651?
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What is the minimum amount of L057-0651 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L057-0651
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L057-0651
  • 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 L057-0651 available by request