SA89-0108 Screening compound: N-{[1-(2,5-dimethylfuran-3-carbonyl)piperidin-4-yl]methyl}-N-[2-(piperidin-1-yl)ethyl]oxan-4-amine

SA89-0108 Screening compound: N-{[1-(2,5-dimethylfuran-3-carbonyl)piperidin-4-yl]methyl}-N-[2-(piperidin-1-yl)ethyl]oxan-4-amine
SA89-0108 Screening compound: N-{[1-(2,5-dimethylfuran-3-carbonyl)piperidin-4-yl]methyl}-N-[2-(piperidin-1-yl)ethyl]oxan-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA89-0108
N-{[1-(2,5-dimethylfuran-3-carbonyl)piperidin-4-yl]methyl}-N-[2-(piperidin-1-yl)ethyl]oxan-4-amine

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

SA89-0108

Molecular Formula

C25H41N3O3 (C25 H41 N3 O3)

Compound Name

N-{[1-(2,5-dimethylfuran-3-carbonyl)piperidin-4-yl]methyl}-N-[2-(piperidin-1-yl)ethyl]oxan-4-amine

IUPAC name

N-{[1-(25-dimethylfuran-3-carbonyl)piperidin-4-yl]methyl}-N-[2-(piperidin-1-yl)ethyl]oxan-4-amine

SMILES

Cc1cc(C(N2CCC(CN(CCN3CCCCC3)C3CCOCC3)CC2)=O)c(C)o1

InChI

InChI=1S/C25H41N3O3/c1-20-18-24(21(2)31-20)25(29)27-12-6-22(7-13-27)19-28(23-8-16-30-17-9-23)15-14-26-10-4-3-5-11-26/h18,22-23H,3-17,19H2,1-2H3

InChI Key

CDRRPEVYCYQGDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32001916

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.62

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.008

Distribution Coefficient, logD

1.252

Water Solubility, LogSw

-3.09

Polar Surface Area

39.080

Acid Dissociation Constant (pKa)

26.65

Base Dissociation Constant (pKb)

9.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

80.00

SA89-0108 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with SA89-0108 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA89-0108?
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What is the minimum amount of SA89-0108 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA89-0108
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA89-0108
  • 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 SA89-0108 available by request