S214-1438 Screening compound: 1-(3-methyl-1H-pyrazole-5-carbonyl)-4-phenyl-3-(pyrrolidin-1-yl)piperidin-4-ol

S214-1438 Screening compound: 1-(3-methyl-1H-pyrazole-5-carbonyl)-4-phenyl-3-(pyrrolidin-1-yl)piperidin-4-ol
S214-1438 Screening compound: 1-(3-methyl-1H-pyrazole-5-carbonyl)-4-phenyl-3-(pyrrolidin-1-yl)piperidin-4-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound S214-1438
1-(3-methyl-1H-pyrazole-5-carbonyl)-4-phenyl-3-(pyrrolidin-1-yl)piperidin-4-ol

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

S214-1438

Molecular Formula

C20H26N4O2 (C20 H26 N4 O2)

Compound Name

1-(3-methyl-1H-pyrazole-5-carbonyl)-4-phenyl-3-(pyrrolidin-1-yl)piperidin-4-ol

IUPAC name

(3R4S)-1-(3-methyl-1H-pyrazole-5-carbonyl)-4-phenyl-3-(pyrrolidin-1-yl)piperidin-4-ol

SMILES

Cc1n[nH]c(C(N(CC[C@]2(c3ccccc3)O)C[C@@H]2N2CCCC2)=O)c1

InChI

InChI=1S/C20H26N4O2/c1-15-13-17(22-21-15)19(25)24-12-9-20(26,16-7-3-2-4-8-16)18(14-24)23-10-5-6-11-23/h2-4,7-8,13,18,26H,5-6,9-12,14H2,1H3,(H,21,22)/t18-,20+/m0/s1

InChI Key

IPTNCOGUXIYMHL-AZUAARDMSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.655

Distribution Coefficient, logD

1.314

Water Solubility, LogSw

-2.08

Polar Surface Area

57.040

Acid Dissociation Constant (pKa)

8.68

Base Dissociation Constant (pKb)

7.48

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

50.00

S214-1438 in Drug Discovery

Included in Screening Libraries

3D Mimetics PPI Library (1617 compounds)

Antiviral Library (67538 compounds)

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

CNS BBB Library (22607 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Epigenetics Focused Set (26518 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Structure:
  • Mimetics
  • 3D
  • Mimetics
  • Mimetics
  • Cyclic compounds
  • Mimetics
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with S214-1438 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S214-1438?
Check Price and Availability of S214-1438, 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 S214-1438 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S214-1438
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S214-1438
  • 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 S214-1438 available by request