P634-0050 Screening compound: tert-butyl 4-(3-{1-[6-(propylamino)pyrimidin-4-yl]piperidin-3-yl}propanoyl)piperazine-1-carboxylate

P634-0050 Screening compound: tert-butyl 4-(3-{1-[6-(propylamino)pyrimidin-4-yl]piperidin-3-yl}propanoyl)piperazine-1-carboxylate
P634-0050 Screening compound: tert-butyl 4-(3-{1-[6-(propylamino)pyrimidin-4-yl]piperidin-3-yl}propanoyl)piperazine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound P634-0050
tert-butyl 4-(3-{1-[6-(propylamino)pyrimidin-4-yl]piperidin-3-yl}propanoyl)piperazine-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

P634-0050

Molecular Formula

C24H40N6O3 (C24 H40 N6 O3)

Compound Name

tert-butyl 4-(3-{1-[6-(propylamino)pyrimidin-4-yl]piperidin-3-yl}propanoyl)piperazine-1-carboxylate

IUPAC name

tert-butyl 4-(3-{1-[6-(propylamino)pyrimidin-4-yl]piperidin-3-yl}propanoyl)piperazine-1-carboxylate

SMILES

CCCNc1cc(N2CC(CCC(N(CC3)CCN3C(OC(C)(C)C)=O)=O)CCC2)ncn1

InChI

InChI=1S/C24H40N6O3/c1-5-10-25-20-16-21(27-18-26-20)30-11-6-7-19(17-30)8-9-22(31)28-12-14-29(15-13-28)23(32)33-24(2,3)4/h16,18-19H,5-15,17H2,1-4H3,(H,25,26,27)/t19-/m1/s1

InChI Key

XVMYSBDQEIKKBN-LJQANCHMSA-N

MDL Number (MFCD)

MFCD27607665

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.206

Distribution Coefficient, logD

4.204

Water Solubility, LogSw

-4.16

Polar Surface Area

71.823

Acid Dissociation Constant (pKa)

18.54

Base Dissociation Constant (pKb)

5.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

75.00

P634-0050 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with P634-0050 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P634-0050?
Check Price and Availability of P634-0050, 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 P634-0050 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P634-0050
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P634-0050
  • 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 P634-0050 available by request