L315-0052 Screening compound: methyl 4-({[3-(1H-indol-2-yl)phenyl]carbamoyl}amino)benzoate

L315-0052 Screening compound: methyl 4-({[3-(1H-indol-2-yl)phenyl]carbamoyl}amino)benzoate
L315-0052 Screening compound: methyl 4-({[3-(1H-indol-2-yl)phenyl]carbamoyl}amino)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound L315-0052
methyl 4-({[3-(1H-indol-2-yl)phenyl]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

L315-0052

Molecular Formula

C23H19N3O3 (C23 H19 N3 O3)

Compound Name

methyl 4-({[3-(1H-indol-2-yl)phenyl]carbamoyl}amino)benzoate

IUPAC name

methyl 4-({[3-(1H-indol-2-yl)phenyl]carbamoyl}amino)benzoate

SMILES

COC(c(cc1)ccc1NC(Nc1cc(-c2cc(cccc3)c3[nH]2)ccc1)=O)=O

InChI

InChI=1S/C23H19N3O3/c1-29-22(27)15-9-11-18(12-10-15)24-23(28)25-19-7-4-6-16(13-19)21-14-17-5-2-3-8-20(17)26-21/h2-14,26H,1H3,(H2,24,25,28)

InChI Key

WHEOQQOEALUVGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15123561

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.242

Distribution Coefficient, logD

6.242

Water Solubility, LogSw

-6.52

Polar Surface Area

62.793

Acid Dissociation Constant (pKa)

12.02

Base Dissociation Constant (pKb)

-0.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

L315-0052 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Indole Derivatives (10091 compounds)

SH2 Library (10483 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Endocrine
  • Cancer
  • Immune system
Structure:
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
Targets:
  • Others

References: we are preparing a list of scientific research reports with L315-0052 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L315-0052?
Check Price and Availability of L315-0052, 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 L315-0052 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L315-0052
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L315-0052
  • 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 L315-0052 available by request