L317-0230 Screening compound: 3-(4-bromo-2-fluorophenyl)-1-[4-(5-fluoro-1H-indol-2-yl)phenyl]urea

L317-0230 Screening compound: 3-(4-bromo-2-fluorophenyl)-1-[4-(5-fluoro-1H-indol-2-yl)phenyl]urea
L317-0230 Screening compound: 3-(4-bromo-2-fluorophenyl)-1-[4-(5-fluoro-1H-indol-2-yl)phenyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L317-0230
3-(4-bromo-2-fluorophenyl)-1-[4-(5-fluoro-1H-indol-2-yl)phenyl]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

L317-0230

Molecular Formula

C21H14BrF2N3O (C21 H14 BrF2 N3 O)

Compound Name

3-(4-bromo-2-fluorophenyl)-1-[4-(5-fluoro-1H-indol-2-yl)phenyl]urea

IUPAC name

3-(4-bromo-2-fluorophenyl)-1-[4-(5-fluoro-1H-indol-2-yl)phenyl]urea

SMILES

O=C(Nc(cc1)ccc1-c1cc(cc(cc2)F)c2[nH]1)Nc(ccc(Br)c1)c1F

InChI

InChI=1S/C21H14BrF2N3O/c22-14-3-7-19(17(24)11-14)27-21(28)25-16-5-1-12(2-6-16)20-10-13-9-15(23)4-8-18(13)26-20/h1-11,26H,(H2,25,27,28)

InChI Key

QJZNKEYKIGRWHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15123721

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.26

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.539

Distribution Coefficient, logD

6.538

Water Solubility, LogSw

-6.41

Polar Surface Area

40.921

Acid Dissociation Constant (pKa)

9.95

Base Dissociation Constant (pKb)

-1.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

L317-0230 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L317-0230 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L317-0230?
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What is the minimum amount of L317-0230 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L317-0230
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L317-0230
  • 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 L317-0230 available by request