SB04-0346 Screening compound: N-{2-[(1-cyclopropanecarbonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-N-methylpyridine-3-sulfonamide

SB04-0346 Screening compound: N-{2-[(1-cyclopropanecarbonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-N-methylpyridine-3-sulfonamide
SB04-0346 Screening compound: N-{2-[(1-cyclopropanecarbonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-N-methylpyridine-3-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB04-0346
N-{2-[(1-cyclopropanecarbonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-N-methylpyridine-3-sulfonamide

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

SB04-0346

Molecular Formula

C21H32N4O4S (C21 H32 N4 O4 S)

Compound Name

N-{2-[(1-cyclopropanecarbonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-N-methylpyridine-3-sulfonamide

IUPAC name

N-{2-[(1-cyclopropanecarbonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-N-methylpyridine-3-sulfonamide

SMILES

CN(CCN(C(CC1)CN1C(C1CC1)=O)C1CCOCC1)S(c1cnccc1)(=O)=O

InChI

InChI=1S/C21H32N4O4S/c1-23(30(27,28)20-3-2-9-22-15-20)11-12-25(18-7-13-29-14-8-18)19-6-10-24(16-19)21(26)17-4-5-17/h2-3,9,15,17-19H,4-8,10-14,16H2,1H3/t19-/m0/s1

InChI Key

QJEGWHXMDZWUPV-IBGZPJMESA-N

MDL Number (MFCD)

MFCD32246519

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.58

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.133

Distribution Coefficient, logD

0.856

Water Solubility, LogSw

-1.62

Polar Surface Area

69.558

Acid Dissociation Constant (pKa)

22.91

Base Dissociation Constant (pKb)

7.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

71.43

SB04-0346 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SB04-0346 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB04-0346?
Check Price and Availability of SB04-0346, 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 SB04-0346 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB04-0346
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB04-0346
  • 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 SB04-0346 available by request