L881-0058 Screening compound: N-(cyclopropylmethyl)-5-methyl-3-(4-methylbenzamido)-1H-indole-2-carboxamide

L881-0058 Screening compound: N-(cyclopropylmethyl)-5-methyl-3-(4-methylbenzamido)-1H-indole-2-carboxamide
L881-0058 Screening compound: N-(cyclopropylmethyl)-5-methyl-3-(4-methylbenzamido)-1H-indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L881-0058
N-(cyclopropylmethyl)-5-methyl-3-(4-methylbenzamido)-1H-indole-2-carboxamide

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

L881-0058

Molecular Formula

C22H23N3O2 (C22 H23 N3 O2)

Compound Name

N-(cyclopropylmethyl)-5-methyl-3-(4-methylbenzamido)-1H-indole-2-carboxamide

IUPAC name

N-(cyclopropylmethyl)-5-methyl-3-(4-methylbenzamido)-1H-indole-2-carboxamide

SMILES

Cc(cc1)ccc1C(Nc1c(C(NCC2CC2)=O)[nH]c2c1cc(C)cc2)=O

InChI

InChI=1S/C22H23N3O2/c1-13-3-8-16(9-4-13)21(26)25-19-17-11-14(2)5-10-18(17)24-20(19)22(27)23-12-15-6-7-15/h3-5,8-11,15,24H,6-7,12H2,1-2H3,(H,23,27)(H,25,26)

InChI Key

KKNXPFQZAFDBCO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27484071

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.448

Distribution Coefficient, logD

3.319

Water Solubility, LogSw

-3.57

Polar Surface Area

56.990

Acid Dissociation Constant (pKa)

7.86

Base Dissociation Constant (pKb)

1.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

L881-0058 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Indole Derivatives (10091 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Targeted Diversity Library (40567 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Targets:
  • GPCR
  • Others
Mechanism of action:
  • Receptor's ligands
  • Epigenetic
  • Epigenetic
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L881-0058 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L881-0058?
Check Price and Availability of L881-0058, 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 L881-0058 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L881-0058
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L881-0058
  • 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 L881-0058 available by request