Y040-9606 Screening compound: 2-(3-ACETYL-1H-INDOL-1-YL)-N-[2-(5-CHLORO-1H-INDOL-3-YL)ETHYL]ACETAMIDE

Y040-9606 Screening compound: 2-(3-ACETYL-1H-INDOL-1-YL)-N-[2-(5-CHLORO-1H-INDOL-3-YL)ETHYL]ACETAMIDE
Y040-9606 Screening compound: 2-(3-ACETYL-1H-INDOL-1-YL)-N-[2-(5-CHLORO-1H-INDOL-3-YL)ETHYL]ACETAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-9606
2-(3-ACETYL-1H-INDOL-1-YL)-N-[2-(5-CHLORO-1H-INDOL-3-YL)ETHYL]ACETAMIDE

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

Y040-9606

Molecular Formula

C22H20ClN3O2 (C22 H20 ClN3 O2)

Compound Name

2-(3-ACETYL-1H-INDOL-1-YL)-N-[2-(5-CHLORO-1H-INDOL-3-YL)ETHYL]ACETAMIDE

IUPAC name

n/a

SMILES

CC(c1cn(CC(NCCc2c[nH]c(cc3)c2cc3Cl)=O)c2c1cccc2)=O

InChI

InChI=1S/C22H20ClN3O2/c1-14(27)19-12-26(21-5-3-2-4-17(19)21)13-22(28)24-9-8-15-11-25-20-7-6-16(23)10-18(15)20/h2-7,10-12,25H,8-9,13H2,1H3,(H,24,28)

InChI Key

FNPDXNKBFFRDCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12215137

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.87

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.486

Distribution Coefficient, logD

3.486

Water Solubility, LogSw

-3.93

Polar Surface Area

49.981

Acid Dissociation Constant (pKa)

14.17

Base Dissociation Constant (pKb)

2.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

Y040-9606 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y040-9606 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-9606?
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What is the minimum amount of Y040-9606 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-9606
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-9606
  • 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 Y040-9606 available by request