S823-2995 Screening compound: N-[4-(hydroxymethyl)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-3-yl]cyclobutanecarboxamide

S823-2995 Screening compound: N-[4-(hydroxymethyl)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-3-yl]cyclobutanecarboxamide
S823-2995 Screening compound: N-[4-(hydroxymethyl)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-3-yl]cyclobutanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S823-2995
N-[4-(hydroxymethyl)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-3-yl]cyclobutanecarboxamide

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

S823-2995

Molecular Formula

C16H24N2O3 (C16 H24 N2 O3)

Compound Name

N-[4-(hydroxymethyl)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-3-yl]cyclobutanecarboxamide

IUPAC name

N-[(3S4R)-4-(hydroxymethyl)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-3-yl]cyclobutanecarboxamide

SMILES

Cc1ccc(CN(C[C@@H]2CO)C[C@@H]2NC(C2CCC2)=O)o1

InChI

InChI=1S/C16H24N2O3/c1-11-5-6-14(21-11)8-18-7-13(10-19)15(9-18)17-16(20)12-3-2-4-12/h5-6,12-13,15,19H,2-4,7-10H2,1H3,(H,17,20)/t13-,15+/m1/s1

InChI Key

DLIOJWBCCHTCDH-HIFRSBDPSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.328

Distribution Coefficient, logD

-2.444

Water Solubility, LogSw

-1.64

Polar Surface Area

53.442

Acid Dissociation Constant (pKa)

15.23

Base Dissociation Constant (pKb)

10.17

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

68.75

S823-2995 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with S823-2995 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S823-2995?
Check Price and Availability of S823-2995, 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 S823-2995 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S823-2995
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S823-2995
  • 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 S823-2995 available by request