S639-0428 Screening compound: N-{(3S,4R)-1-BENZYL-4-[(DIMETHYLAMINO)METHYL]TETRAHYDRO-1H-PYRROL-3-YL}-2-FURAMIDE

S639-0428 Screening compound: N-{(3S,4R)-1-BENZYL-4-[(DIMETHYLAMINO)METHYL]TETRAHYDRO-1H-PYRROL-3-YL}-2-FURAMIDE
S639-0428 Screening compound: N-{(3S,4R)-1-BENZYL-4-[(DIMETHYLAMINO)METHYL]TETRAHYDRO-1H-PYRROL-3-YL}-2-FURAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound S639-0428
N-{(3S,4R)-1-BENZYL-4-[(DIMETHYLAMINO)METHYL]TETRAHYDRO-1H-PYRROL-3-YL}-2-FURAMIDE

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

S639-0428

Molecular Formula

C19H25N3O2 (C19 H25 N3 O2)

Compound Name

N-{(3S,4R)-1-BENZYL-4-[(DIMETHYLAMINO)METHYL]TETRAHYDRO-1H-PYRROL-3-YL}-2-FURAMIDE

IUPAC name

n/a

SMILES

CN(C)C[C@@H](CN(Cc1ccccc1)C1)[C@H]1NC(c1ccco1)=O

InChI

InChI=1S/C19H25N3O2/c1-21(2)12-16-13-22(11-15-7-4-3-5-8-15)14-17(16)20-19(23)18-9-6-10-24-18/h3-10,16-17H,11-14H2,1-2H3,(H,20,23)/t16-,17-/m0/s1

InChI Key

YRAMVAJEJNERMN-IRXDYDNUSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.611

Distribution Coefficient, logD

-0.456

Water Solubility, LogSw

-1.91

Polar Surface Area

41.006

Acid Dissociation Constant (pKa)

14.62

Base Dissociation Constant (pKb)

9.46

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

42.10

S639-0428 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

GPCR Targeted Library (31838 compounds)

Immunological Library (6760 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with S639-0428 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S639-0428?
Check Price and Availability of S639-0428, 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 S639-0428 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S639-0428
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S639-0428
  • 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 S639-0428 available by request