SB04-0281 Screening compound: N-{2-[(1-cyclopropanecarbonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-3-methoxy-N-methylbenzamide

SB04-0281 Screening compound: N-{2-[(1-cyclopropanecarbonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-3-methoxy-N-methylbenzamide
SB04-0281 Screening compound: N-{2-[(1-cyclopropanecarbonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-3-methoxy-N-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB04-0281
N-{2-[(1-cyclopropanecarbonylpyrrolidin-3-yl)(oxan-4-yl)amino]ethyl}-3-methoxy-N-methylbenzamide

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

SB04-0281

Molecular Formula

C24H35N3O4 (C24 H35 N3 O4)

Compound Name

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

IUPAC name

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

SMILES

CN(CCN(C(CC1)CN1C(C1CC1)=O)C1CCOCC1)C(c1cc(OC)ccc1)=O

InChI

InChI=1S/C24H35N3O4/c1-25(23(28)19-4-3-5-22(16-19)30-2)12-13-27(20-9-14-31-15-10-20)21-8-11-26(17-21)24(29)18-6-7-18/h3-5,16,18,20-21H,6-15,17H2,1-2H3/t21-/m0/s1

InChI Key

AQAFEOJHYLPFBB-NRFANRHFSA-N

MDL Number (MFCD)

MFCD32246001

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.883

Distribution Coefficient, logD

1.471

Water Solubility, LogSw

-2.16

Polar Surface Area

51.170

Acid Dissociation Constant (pKa)

22.91

Base Dissociation Constant (pKb)

7.60

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.67

SB04-0281 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SB04-0281 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB04-0281?
Check Price and Availability of SB04-0281, 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 SB04-0281 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB04-0281
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB04-0281
  • 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 SB04-0281 available by request