P435-0078 Screening compound: N,N,5-trimethyl-2-[1-(3-methylthiophene-2-carbonyl)piperidin-4-yl]-1,3-oxazole-4-carboxamide

P435-0078 Screening compound: N,N,5-trimethyl-2-[1-(3-methylthiophene-2-carbonyl)piperidin-4-yl]-1,3-oxazole-4-carboxamide
P435-0078 Screening compound: N,N,5-trimethyl-2-[1-(3-methylthiophene-2-carbonyl)piperidin-4-yl]-1,3-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P435-0078
N,N,5-trimethyl-2-[1-(3-methylthiophene-2-carbonyl)piperidin-4-yl]-1,3-oxazole-4-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

P435-0078

Molecular Formula

C18H23N3O3S (C18 H23 N3 O3 S)

Compound Name

N,N,5-trimethyl-2-[1-(3-methylthiophene-2-carbonyl)piperidin-4-yl]-1,3-oxazole-4-carboxamide

IUPAC name

NN5-trimethyl-2-[1-(3-methylthiophene-2-carbonyl)piperidin-4-yl]-13-oxazole-4-carboxamide

SMILES

Cc1c(C(N(CC2)CCC2c2nc(C(N(C)C)=O)c(C)o2)=O)scc1

InChI

InChI=1S/C18H23N3O3S/c1-11-7-10-25-15(11)18(23)21-8-5-13(6-9-21)16-19-14(12(2)24-16)17(22)20(3)4/h7,10,13H,5-6,8-9H2,1-4H3

InChI Key

JASKLBLOBAXCTJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27574945

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.899

Distribution Coefficient, logD

1.899

Water Solubility, LogSw

-2.25

Polar Surface Area

51.532

Acid Dissociation Constant (pKa)

26.24

Base Dissociation Constant (pKb)

-0.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

P435-0078 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with P435-0078 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P435-0078?
Check Price and Availability of P435-0078, 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 P435-0078 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P435-0078
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P435-0078
  • 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 P435-0078 available by request