Y041-8159 Screening compound: N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-1-methyl-1H-indole-2-carboxamide

Y041-8159 Screening compound: N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-1-methyl-1H-indole-2-carboxamide
Y041-8159 Screening compound: N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-1-methyl-1H-indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-8159
N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-1-methyl-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

Y041-8159

Molecular Formula

C19H18N4O (C19 H18 N4 O)

Compound Name

N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-1-methyl-1H-indole-2-carboxamide

IUPAC name

N-[2-(1H-13-benzodiazol-2-yl)ethyl]-1-methyl-1H-indole-2-carboxamide

SMILES

Cn(c(C(NCCc1nc(cccc2)c2[nH]1)=O)c1)c2c1cccc2

InChI

InChI=1S/C19H18N4O/c1-23-16-9-5-2-6-13(16)12-17(23)19(24)20-11-10-18-21-14-7-3-4-8-15(14)22-18/h2-9,12H,10-11H2,1H3,(H,20,24)(H,21,22)

InChI Key

ZITULIKGKCWNMA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28986891

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.38

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.087

Distribution Coefficient, logD

3.087

Water Solubility, LogSw

-3.44

Polar Surface Area

46.310

Acid Dissociation Constant (pKa)

13.46

Base Dissociation Constant (pKb)

4.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.79

Y041-8159 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y041-8159 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-8159?
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What is the minimum amount of Y041-8159 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-8159
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-8159
  • 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 Y041-8159 available by request