L057-0191 Screening compound: 1-(4-ethylphenyl)-3-{[1-(4-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}urea

L057-0191 Screening compound: 1-(4-ethylphenyl)-3-{[1-(4-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}urea
L057-0191 Screening compound: 1-(4-ethylphenyl)-3-{[1-(4-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L057-0191
1-(4-ethylphenyl)-3-{[1-(4-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}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

L057-0191

Molecular Formula

C26H27N3O2 (C26 H27 N3 O2)

Compound Name

1-(4-ethylphenyl)-3-{[1-(4-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}urea

IUPAC name

1-(4-ethylphenyl)-3-{[1-(4-methylbenzoyl)-23-dihydro-1H-indol-6-yl]methyl}urea

SMILES

CCc(cc1)ccc1NC(NCc1cc(N(CC2)C(c3ccc(C)cc3)=O)c2cc1)=O

InChI

InChI=1S/C26H27N3O2/c1-3-19-7-12-23(13-8-19)28-26(31)27-17-20-6-11-21-14-15-29(24(21)16-20)25(30)22-9-4-18(2)5-10-22/h4-13,16H,3,14-15,17H2,1-2H3,(H2,27,28,31)

InChI Key

VHQPYJNJNPOSMZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27226998

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.52

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

5.245

Distribution Coefficient, logD

5.245

Water Solubility, LogSw

-4.95

Polar Surface Area

49.542

Acid Dissociation Constant (pKa)

13.93

Base Dissociation Constant (pKb)

0.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

L057-0191 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 L057-0191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L057-0191?
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What is the minimum amount of L057-0191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L057-0191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L057-0191
  • 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 L057-0191 available by request