P091-0020 Screening compound: 1-(4-METHYL-1,4-DIAZEPAN-1-YL)-3-(1-METHYL-1H-INDOL-5-YL)-1-PROPANONE

P091-0020 Screening compound: 1-(4-METHYL-1,4-DIAZEPAN-1-YL)-3-(1-METHYL-1H-INDOL-5-YL)-1-PROPANONE
P091-0020 Screening compound: 1-(4-METHYL-1,4-DIAZEPAN-1-YL)-3-(1-METHYL-1H-INDOL-5-YL)-1-PROPANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound P091-0020
1-(4-METHYL-1,4-DIAZEPAN-1-YL)-3-(1-METHYL-1H-INDOL-5-YL)-1-PROPANONE

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

P091-0020

Molecular Formula

C18H25N3O (C18 H25 N3 O)

Compound Name

1-(4-METHYL-1,4-DIAZEPAN-1-YL)-3-(1-METHYL-1H-INDOL-5-YL)-1-PROPANONE

IUPAC name

n/a

SMILES

Cn(cc1)c2c1cc(CCC(N1CCN(C)CCC1)=O)cc2

InChI

InChI=1S/C18H25N3O/c1-19-9-3-10-21(13-12-19)18(22)7-5-15-4-6-17-16(14-15)8-11-20(17)2/h4,6,8,11,14H,3,5,7,9-10,12-13H2,1-2H3

InChI Key

PTDRCSQHTRJTRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27563751

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

299.42

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.064

Distribution Coefficient, logD

0.692

Water Solubility, LogSw

-2.54

Polar Surface Area

22.833

Acid Dissociation Constant (pKa)

23.16

Base Dissociation Constant (pKb)

8.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

P091-0020 in Drug Discovery

Included in Screening Libraries

Hsp90-Targeted Library (11355 compounds)

Indole Derivatives (10091 compounds)

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
Structure:
  • Cyclic compounds
  • Mimetics
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with P091-0020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P091-0020?
Check Price and Availability of P091-0020, 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 P091-0020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P091-0020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P091-0020
  • 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 P091-0020 available by request