SA23-1368 Screening compound: N-[(4,4-difluoro-1-{1-[2-(4-methyl-1H-pyrazol-1-yl)acetyl]azetidin-3-yl}pyrrolidin-2-yl)methyl]acetamide

SA23-1368 Screening compound: N-[(4,4-difluoro-1-{1-[2-(4-methyl-1H-pyrazol-1-yl)acetyl]azetidin-3-yl}pyrrolidin-2-yl)methyl]acetamide
SA23-1368 Screening compound: N-[(4,4-difluoro-1-{1-[2-(4-methyl-1H-pyrazol-1-yl)acetyl]azetidin-3-yl}pyrrolidin-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA23-1368
N-[(4,4-difluoro-1-{1-[2-(4-methyl-1H-pyrazol-1-yl)acetyl]azetidin-3-yl}pyrrolidin-2-yl)methyl]acetamide

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

SA23-1368

Molecular Formula

C16H23F2N5O2 (C16 H23 F2 N5 O2)

Compound Name

N-[(4,4-difluoro-1-{1-[2-(4-methyl-1H-pyrazol-1-yl)acetyl]azetidin-3-yl}pyrrolidin-2-yl)methyl]acetamide

IUPAC name

N-{[(2S)-44-difluoro-1-{1-[2-(4-methyl-1H-pyrazol-1-yl)acetyl]azetidin-3-yl}pyrrolidin-2-yl]methyl}acetamide

SMILES

CC(NC[C@H](CC(C1)(F)F)N1C(C1)CN1C(Cn1ncc(C)c1)=O)=O

InChI

InChI=1S/C16H23F2N5O2/c1-11-4-20-22(6-11)9-15(25)21-7-14(8-21)23-10-16(17,18)3-13(23)5-19-12(2)24/h4,6,13-14H,3,5,7-10H2,1-2H3,(H,19,24)/t13-/m1/s1

InChI Key

LFVUCZVZKIPQRU-CYBMUJFWSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.446

Distribution Coefficient, logD

-0.446

Water Solubility, LogSw

-0.81

Polar Surface Area

58.957

Acid Dissociation Constant (pKa)

13.99

Base Dissociation Constant (pKb)

3.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

68.75

SA23-1368 in Drug Discovery

Included in Screening Libraries

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

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

Protein-Protein Interaction Library (218420 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with SA23-1368 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA23-1368?
Check Price and Availability of SA23-1368, 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 SA23-1368 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA23-1368
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA23-1368
  • 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 SA23-1368 available by request