P970-1150 Screening compound: N~5~-methyl-N~5~-[(4-methyltetrahydro-2H-pyran-4-yl)methyl]-3-(2-thienyl)-1H-pyrazole-5-carboxamide

P970-1150 Screening compound: N~5~-methyl-N~5~-[(4-methyltetrahydro-2H-pyran-4-yl)methyl]-3-(2-thienyl)-1H-pyrazole-5-carboxamide
P970-1150 Screening compound: N~5~-methyl-N~5~-[(4-methyltetrahydro-2H-pyran-4-yl)methyl]-3-(2-thienyl)-1H-pyrazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P970-1150
N~5~-methyl-N~5~-[(4-methyltetrahydro-2H-pyran-4-yl)methyl]-3-(2-thienyl)-1H-pyrazole-5-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

P970-1150

Molecular Formula

C16H21N3O2S (C16 H21 N3 O2 S)

Compound Name

N~5~-methyl-N~5~-[(4-methyltetrahydro-2H-pyran-4-yl)methyl]-3-(2-thienyl)-1H-pyrazole-5-carboxamide

IUPAC name

N-methyl-N-[(4-methyloxan-4-yl)methyl]-3-(thiophen-2-yl)-1H-pyrazole-5-carboxamide

SMILES

CC1(CN(C)C(c2cc(-c3cccs3)n[nH]2)=O)CCOCC1

InChI

InChI=1S/C16H21N3O2S/c1-16(5-7-21-8-6-16)11-19(2)15(20)13-10-12(17-18-13)14-4-3-9-22-14/h3-4,9-10H,5-8,11H2,1-2H3,(H,17,18)

InChI Key

JQQMSQGHRAEVNO-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.608

Distribution Coefficient, logD

2.608

Water Solubility, LogSw

-2.87

Polar Surface Area

47.998

Acid Dissociation Constant (pKa)

8.60

Base Dissociation Constant (pKb)

1.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

P970-1150 in Drug Discovery

Included in Screening Libraries

Bcl2-PPI Inhibitors Library (12246 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Soluble Diversity Library (15920 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with P970-1150 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P970-1150?
Check Price and Availability of P970-1150, 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 P970-1150 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P970-1150
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P970-1150
  • 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 P970-1150 available by request