P510-0631 Screening compound: N-(4-ethoxyphenyl)-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]piperidine-4-carboxamide

P510-0631 Screening compound: N-(4-ethoxyphenyl)-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]piperidine-4-carboxamide
P510-0631 Screening compound: N-(4-ethoxyphenyl)-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P510-0631
N-(4-ethoxyphenyl)-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]piperidine-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

P510-0631

Molecular Formula

C22H29N5O2S (C22 H29 N5 O2 S)

Compound Name

N-(4-ethoxyphenyl)-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]piperidine-4-carboxamide

IUPAC name

N-(4-ethoxyphenyl)-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]piperidine-4-carboxamide

SMILES

CCOc(cc1)ccc1NC(C(CC1)CCN1c1cc(N2CCSCC2)ncn1)=O

InChI

InChI=1S/C22H29N5O2S/c1-2-29-19-5-3-18(4-6-19)25-22(28)17-7-9-26(10-8-17)20-15-21(24-16-23-20)27-11-13-30-14-12-27/h3-6,15-17H,2,7-14H2,1H3,(H,25,28)

InChI Key

WAHHSNVZFGNYLU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27577846

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.034

Distribution Coefficient, logD

4.017

Water Solubility, LogSw

-3.92

Polar Surface Area

56.095

Acid Dissociation Constant (pKa)

11.75

Base Dissociation Constant (pKb)

6.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

P510-0631 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P510-0631 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P510-0631?
Check Price and Availability of P510-0631, 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 P510-0631 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P510-0631
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P510-0631
  • 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 P510-0631 available by request