L317-0244 Screening compound: ethyl 3-({[4-(5-fluoro-1H-indol-2-yl)phenyl]carbamoyl}amino)-3-phenylpropanoate

L317-0244 Screening compound: ethyl 3-({[4-(5-fluoro-1H-indol-2-yl)phenyl]carbamoyl}amino)-3-phenylpropanoate
L317-0244 Screening compound: ethyl 3-({[4-(5-fluoro-1H-indol-2-yl)phenyl]carbamoyl}amino)-3-phenylpropanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound L317-0244
ethyl 3-({[4-(5-fluoro-1H-indol-2-yl)phenyl]carbamoyl}amino)-3-phenylpropanoate

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

L317-0244

Molecular Formula

C26H24FN3O3 (C26 H24 FN3 O3)

Compound Name

ethyl 3-({[4-(5-fluoro-1H-indol-2-yl)phenyl]carbamoyl}amino)-3-phenylpropanoate

IUPAC name

ethyl 3-({[4-(5-fluoro-1H-indol-2-yl)phenyl]carbamoyl}amino)-3-phenylpropanoate

SMILES

CCOC(CC(c1ccccc1)NC(Nc(cc1)ccc1-c1cc(cc(cc2)F)c2[nH]1)=O)=O

InChI

InChI=1S/C26H24FN3O3/c1-2-33-25(31)16-24(17-6-4-3-5-7-17)30-26(32)28-21-11-8-18(9-12-21)23-15-19-14-20(27)10-13-22(19)29-23/h3-15,24,29H,2,16H2,1H3,(H2,28,30,32)/t24-/m0/s1

InChI Key

BTBQBOZPRIDYDB-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD15123729

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.604

Distribution Coefficient, logD

5.604

Water Solubility, LogSw

-5.69

Polar Surface Area

62.730

Acid Dissociation Constant (pKa)

14.03

Base Dissociation Constant (pKb)

-0.91

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.40

L317-0244 in Drug Discovery

Included in Screening Libraries

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

Indole Derivatives (10091 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with L317-0244 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L317-0244?
Check Price and Availability of L317-0244, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of L317-0244 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L317-0244
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L317-0244
  • 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 L317-0244 available by request