SA94-0103 Screening compound: N-benzyl-1-(2-cyclopentylacetyl)-3-fluoropyrrolidine-3-carboxamide

SA94-0103 Screening compound: N-benzyl-1-(2-cyclopentylacetyl)-3-fluoropyrrolidine-3-carboxamide
SA94-0103 Screening compound: N-benzyl-1-(2-cyclopentylacetyl)-3-fluoropyrrolidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA94-0103
N-benzyl-1-(2-cyclopentylacetyl)-3-fluoropyrrolidine-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

SA94-0103

Molecular Formula

C19H25FN2O2 (C19 H25 FN2 O2)

Compound Name

N-benzyl-1-(2-cyclopentylacetyl)-3-fluoropyrrolidine-3-carboxamide

IUPAC name

N-benzyl-1-(2-cyclopentylacetyl)-3-fluoropyrrolidine-3-carboxamide

SMILES

O=C(CC1CCCC1)N(CC1)CC1(C(NCc1ccccc1)=O)F

InChI

InChI=1S/C19H25FN2O2/c20-19(18(24)21-13-16-8-2-1-3-9-16)10-11-22(14-19)17(23)12-15-6-4-5-7-15/h1-3,8-9,15H,4-7,10-14H2,(H,21,24)/t19-/m0/s1

InChI Key

WEVZZEFWWLMPIN-IBGZPJMESA-N

MDL Number (MFCD)

MFCD32245179

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.871

Distribution Coefficient, logD

2.871

Water Solubility, LogSw

-3.34

Polar Surface Area

41.630

Acid Dissociation Constant (pKa)

11.08

Base Dissociation Constant (pKb)

-2.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.90

SA94-0103 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

ACE2 Library (3043 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with SA94-0103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA94-0103?
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What is the minimum amount of SA94-0103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA94-0103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA94-0103
  • 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 SA94-0103 available by request