SB04-0244 Screening compound: N-{2-[(1-methanesulfonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-N-methyl-2-phenoxyacetamide

SB04-0244 Screening compound: N-{2-[(1-methanesulfonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-N-methyl-2-phenoxyacetamide
SB04-0244 Screening compound: N-{2-[(1-methanesulfonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-N-methyl-2-phenoxyacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB04-0244
N-{2-[(1-methanesulfonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-N-methyl-2-phenoxyacetamide

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

SB04-0244

Molecular Formula

C21H33N3O5S (C21 H33 N3 O5 S)

Compound Name

N-{2-[(1-methanesulfonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-N-methyl-2-phenoxyacetamide

IUPAC name

N-{2-[(1-methanesulfonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-N-methyl-2-phenoxyacetamide

SMILES

CN(CCN(C(CC1)CN1S(C)(=O)=O)C1CCOCC1)C(COc1ccccc1)=O

InChI

InChI=1S/C21H33N3O5S/c1-22(21(25)17-29-20-6-4-3-5-7-20)12-13-24(18-9-14-28-15-10-18)19-8-11-23(16-19)30(2,26)27/h3-7,18-19H,8-17H2,1-2H3/t19-/m1/s1

InChI Key

KZLFBUSAYCOKAX-LJQANCHMSA-N

MDL Number (MFCD)

MFCD32245730

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.58

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.048

Distribution Coefficient, logD

1.024

Water Solubility, LogSw

-2.11

Polar Surface Area

64.901

Acid Dissociation Constant (pKa)

24.48

Base Dissociation Constant (pKb)

6.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.67

SB04-0244 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SB04-0244 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB04-0244?
Check Price and Availability of SB04-0244, 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 SB04-0244 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB04-0244
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB04-0244
  • 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 SB04-0244 available by request