L409-0171 Screening compound: methyl 3-({[1-(2,3-dihydro-1H-indol-1-yl)-1-oxopropan-2-yl]carbamoyl}amino)benzoate

L409-0171 Screening compound: methyl 3-({[1-(2,3-dihydro-1H-indol-1-yl)-1-oxopropan-2-yl]carbamoyl}amino)benzoate
L409-0171 Screening compound: methyl 3-({[1-(2,3-dihydro-1H-indol-1-yl)-1-oxopropan-2-yl]carbamoyl}amino)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound L409-0171
methyl 3-({[1-(2,3-dihydro-1H-indol-1-yl)-1-oxopropan-2-yl]carbamoyl}amino)benzoate

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

L409-0171

Molecular Formula

C20H21N3O4 (C20 H21 N3 O4)

Compound Name

methyl 3-({[1-(2,3-dihydro-1H-indol-1-yl)-1-oxopropan-2-yl]carbamoyl}amino)benzoate

IUPAC name

methyl 3-({[1-(23-dihydro-1H-indol-1-yl)-1-oxopropan-2-yl]carbamoyl}amino)benzoate

SMILES

CC(C(N(CC1)c2c1cccc2)=O)NC(Nc1cc(C(OC)=O)ccc1)=O

InChI

InChI=1S/C20H21N3O4/c1-13(18(24)23-11-10-14-6-3-4-9-17(14)23)21-20(26)22-16-8-5-7-15(12-16)19(25)27-2/h3-9,12-13H,10-11H2,1-2H3,(H2,21,22,26)/t13-/m0/s1

InChI Key

NUKZBQCRNNTBAW-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD15126317

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.980

Distribution Coefficient, logD

2.980

Water Solubility, LogSw

-3.47

Polar Surface Area

70.151

Acid Dissociation Constant (pKa)

13.45

Base Dissociation Constant (pKb)

2.53

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

L409-0171 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Cancer
  • Endocrine
Targets:
  • Others
Mechanism of action:
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with L409-0171 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L409-0171?
Check Price and Availability of L409-0171, 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 L409-0171 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L409-0171
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L409-0171
  • 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 L409-0171 available by request