L439-0048 Screening compound: ethyl 3-({[1-(4-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]carbamoyl}amino)-3-phenylpropanoate

L439-0048 Screening compound: ethyl 3-({[1-(4-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]carbamoyl}amino)-3-phenylpropanoate
L439-0048 Screening compound: ethyl 3-({[1-(4-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]carbamoyl}amino)-3-phenylpropanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound L439-0048
ethyl 3-({[1-(4-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]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

L439-0048

Molecular Formula

C28H29N3O4 (C28 H29 N3 O4)

Compound Name

ethyl 3-({[1-(4-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]carbamoyl}amino)-3-phenylpropanoate

IUPAC name

ethyl 3-({[1-(4-methylbenzoyl)-23-dihydro-1H-indol-6-yl]carbamoyl}amino)-3-phenylpropanoate

SMILES

CCOC(CC(c1ccccc1)NC(Nc1cc(N(CC2)C(c3ccc(C)cc3)=O)c2cc1)=O)=O

InChI

InChI=1S/C28H29N3O4/c1-3-35-26(32)18-24(20-7-5-4-6-8-20)30-28(34)29-23-14-13-21-15-16-31(25(21)17-23)27(33)22-11-9-19(2)10-12-22/h4-14,17,24H,3,15-16,18H2,1-2H3,(H2,29,30,34)/t24-/m0/s1

InChI Key

UIGIZLUCGFHQQF-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD15127370

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.883

Distribution Coefficient, logD

4.883

Water Solubility, LogSw

-4.45

Polar Surface Area

69.331

Acid Dissociation Constant (pKa)

13.70

Base Dissociation Constant (pKb)

0.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

L439-0048 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

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 L439-0048 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L439-0048?
Check Price and Availability of L439-0048, 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 L439-0048 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L439-0048
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L439-0048
  • 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 L439-0048 available by request