P634-0220 Screening compound: ethyl 4-(3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl}propanamido)piperidine-1-carboxylate

P634-0220 Screening compound: ethyl 4-(3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl}propanamido)piperidine-1-carboxylate
P634-0220 Screening compound: ethyl 4-(3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl}propanamido)piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound P634-0220
ethyl 4-(3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl}propanamido)piperidine-1-carboxylate

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

P634-0220

Molecular Formula

C22H36N6O3 (C22 H36 N6 O3)

Compound Name

ethyl 4-(3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl}propanamido)piperidine-1-carboxylate

IUPAC name

ethyl 4-(3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl}propanamido)piperidine-1-carboxylate

SMILES

CCNc1cc(N2CC(CCC(NC(CC3)CCN3C(OCC)=O)=O)CCC2)ncn1

InChI

InChI=1S/C22H36N6O3/c1-3-23-19-14-20(25-16-24-19)28-11-5-6-17(15-28)7-8-21(29)26-18-9-12-27(13-10-18)22(30)31-4-2/h14,16-18H,3-13,15H2,1-2H3,(H,26,29)(H,23,24,25)/t17-/m1/s1

InChI Key

ONEGVCACTDIYMS-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD27607800

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.886

Distribution Coefficient, logD

2.874

Water Solubility, LogSw

-3.19

Polar Surface Area

80.302

Acid Dissociation Constant (pKa)

16.14

Base Dissociation Constant (pKb)

5.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

72.70

P634-0220 in Drug Discovery

Included in Screening Libraries

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

Eccentric PPI Library (11937 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

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

References: we are preparing a list of scientific research reports with P634-0220 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P634-0220?
Check Price and Availability of P634-0220, 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 P634-0220 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P634-0220
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P634-0220
  • 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 P634-0220 available by request