P634-0285 Screening compound: 3-{1-[6-(cyclopropylamino)pyrimidin-4-yl]piperidin-3-yl}-1-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-one

P634-0285 Screening compound: 3-{1-[6-(cyclopropylamino)pyrimidin-4-yl]piperidin-3-yl}-1-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-one
P634-0285 Screening compound: 3-{1-[6-(cyclopropylamino)pyrimidin-4-yl]piperidin-3-yl}-1-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P634-0285
3-{1-[6-(cyclopropylamino)pyrimidin-4-yl]piperidin-3-yl}-1-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-one

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

P634-0285

Molecular Formula

C26H36N6O2 (C26 H36 N6 O2)

Compound Name

3-{1-[6-(cyclopropylamino)pyrimidin-4-yl]piperidin-3-yl}-1-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-one

IUPAC name

3-{1-[6-(cyclopropylamino)pyrimidin-4-yl]piperidin-3-yl}-1-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-one

SMILES

COc1cccc(N(CC2)CCN2C(CCC(CCC2)CN2c2ncnc(NC3CC3)c2)=O)c1

InChI

InChI=1S/C26H36N6O2/c1-34-23-6-2-5-22(16-23)30-12-14-31(15-13-30)26(33)10-7-20-4-3-11-32(18-20)25-17-24(27-19-28-25)29-21-8-9-21/h2,5-6,16-17,19-21H,3-4,7-15,18H2,1H3,(H,27,28,29)/t20-/m1/s1

InChI Key

UGPKFGJHDASIBY-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD27642075

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.61

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.944

Distribution Coefficient, logD

3.943

Water Solubility, LogSw

-4.08

Polar Surface Area

60.681

Acid Dissociation Constant (pKa)

16.66

Base Dissociation Constant (pKb)

4.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.70

P634-0285 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P634-0285 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P634-0285?
Check Price and Availability of P634-0285, 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 P634-0285 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P634-0285
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P634-0285
  • 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 P634-0285 available by request