P435-1718 Screening compound: 1-(3-methyl-1H-indazol-1-yl)-4-{4-[5-methyl-4-(morpholine-4-carbonyl)-1,3-oxazol-2-yl]piperidin-1-yl}butane-1,4-dione

P435-1718 Screening compound: 1-(3-methyl-1H-indazol-1-yl)-4-{4-[5-methyl-4-(morpholine-4-carbonyl)-1,3-oxazol-2-yl]piperidin-1-yl}butane-1,4-dione
P435-1718 Screening compound: 1-(3-methyl-1H-indazol-1-yl)-4-{4-[5-methyl-4-(morpholine-4-carbonyl)-1,3-oxazol-2-yl]piperidin-1-yl}butane-1,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound P435-1718
1-(3-methyl-1H-indazol-1-yl)-4-{4-[5-methyl-4-(morpholine-4-carbonyl)-1,3-oxazol-2-yl]piperidin-1-yl}butane-1,4-dione

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

P435-1718

Molecular Formula

C26H31N5O5 (C26 H31 N5 O5)

Compound Name

1-(3-methyl-1H-indazol-1-yl)-4-{4-[5-methyl-4-(morpholine-4-carbonyl)-1,3-oxazol-2-yl]piperidin-1-yl}butane-1,4-dione

IUPAC name

1-(3-methyl-1H-indazol-1-yl)-4-{4-[5-methyl-4-(morpholine-4-carbonyl)-13-oxazol-2-yl]piperidin-1-yl}butane-14-dione

SMILES

Cc1nn(C(CCC(N(CC2)CCC2c2nc(C(N3CCOCC3)=O)c(C)o2)=O)=O)c2c1cccc2

InChI

InChI=1S/C26H31N5O5/c1-17-20-5-3-4-6-21(20)31(28-17)23(33)8-7-22(32)29-11-9-19(10-12-29)25-27-24(18(2)36-25)26(34)30-13-15-35-16-14-30/h3-6,19H,7-16H2,1-2H3

InChI Key

HJBCPRWBVYMEEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31992814

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

493.56

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.986

Distribution Coefficient, logD

0.986

Water Solubility, LogSw

-1.83

Polar Surface Area

85.404

Acid Dissociation Constant (pKa)

14.83

Base Dissociation Constant (pKb)

-0.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

P435-1718 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with P435-1718 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P435-1718?
Check Price and Availability of P435-1718, 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 P435-1718 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P435-1718
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P435-1718
  • 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 P435-1718 available by request