SA17-0187 Screening compound: 2-methyl-1-(2-methylpropyl)-6-oxo-N-[2-(1H-pyrazol-1-yl)ethyl]piperidine-3-carboxamide

SA17-0187 Screening compound: 2-methyl-1-(2-methylpropyl)-6-oxo-N-[2-(1H-pyrazol-1-yl)ethyl]piperidine-3-carboxamide
SA17-0187 Screening compound: 2-methyl-1-(2-methylpropyl)-6-oxo-N-[2-(1H-pyrazol-1-yl)ethyl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA17-0187
2-methyl-1-(2-methylpropyl)-6-oxo-N-[2-(1H-pyrazol-1-yl)ethyl]piperidine-3-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

SA17-0187

Molecular Formula

C16H26N4O2 (C16 H26 N4 O2)

Compound Name

2-methyl-1-(2-methylpropyl)-6-oxo-N-[2-(1H-pyrazol-1-yl)ethyl]piperidine-3-carboxamide

IUPAC name

(2R3R)-2-methyl-1-(2-methylpropyl)-6-oxo-N-[2-(1H-pyrazol-1-yl)ethyl]piperidine-3-carboxamide

SMILES

CC(C)CN([C@@H](C)[C@H](CC1)C(NCCn2nccc2)=O)C1=O

InChI

InChI=1S/C16H26N4O2/c1-12(2)11-20-13(3)14(5-6-15(20)21)16(22)17-8-10-19-9-4-7-18-19/h4,7,9,12-14H,5-6,8,10-11H2,1-3H3,(H,17,22)/t13-,14+/m0/s1

InChI Key

GFMJYLRYWGMMTQ-UONOGXRCSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.951

Distribution Coefficient, logD

0.951

Water Solubility, LogSw

-2.20

Polar Surface Area

55.362

Acid Dissociation Constant (pKa)

13.87

Base Dissociation Constant (pKb)

1.99

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

68.75

SA17-0187 in Drug Discovery

Included in Screening Libraries

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

CNS MPO Library (28609 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with SA17-0187 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA17-0187?
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What is the minimum amount of SA17-0187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA17-0187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA17-0187
  • 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 SA17-0187 available by request