P857-1011 Screening compound: 4-[6-(4-ethylpiperazine-1-carbonyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]thiomorpholine

P857-1011 Screening compound: 4-[6-(4-ethylpiperazine-1-carbonyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]thiomorpholine
P857-1011 Screening compound: 4-[6-(4-ethylpiperazine-1-carbonyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]thiomorpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound P857-1011
4-[6-(4-ethylpiperazine-1-carbonyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]thiomorpholine

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

P857-1011

Molecular Formula

C17H25N7OS (C17 H25 N7 OS)

Compound Name

4-[6-(4-ethylpiperazine-1-carbonyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]thiomorpholine

IUPAC name

4-[6-(4-ethylpiperazine-1-carbonyl)-1-methyl-1H-pyrazolo[34-d]pyrimidin-4-yl]thiomorpholine

SMILES

CCN(CC1)CCN1C(c1nc(n(C)nc2)c2c(N2CCSCC2)n1)=O

InChI

InChI=1S/C17H25N7OS/c1-3-22-4-6-24(7-5-22)17(25)14-19-15-13(12-18-21(15)2)16(20-14)23-8-10-26-11-9-23/h12H,3-11H2,1-2H3

InChI Key

MDPXXGXNZLZSHU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29025940

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.089

Distribution Coefficient, logD

0.910

Water Solubility, LogSw

-1.56

Polar Surface Area

57.228

Acid Dissociation Constant (pKa)

21.40

Base Dissociation Constant (pKb)

7.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

64.70

P857-1011 in Drug Discovery

Included in Screening Libraries

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

Protein Arginine Methyltransferases Library (27925 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with P857-1011 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P857-1011?
Check Price and Availability of P857-1011, 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 P857-1011 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P857-1011
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P857-1011
  • 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 P857-1011 available by request