SA64-1163 Screening compound: N~3~-({9-[2-(2-chlorophenyl)acetyl]-1-oxa-9-azaspiro[5.5]undec-4-yl}methyl)nicotinamide

SA64-1163 Screening compound: N~3~-({9-[2-(2-chlorophenyl)acetyl]-1-oxa-9-azaspiro[5.5]undec-4-yl}methyl)nicotinamide
SA64-1163 Screening compound: N~3~-({9-[2-(2-chlorophenyl)acetyl]-1-oxa-9-azaspiro[5.5]undec-4-yl}methyl)nicotinamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA64-1163
N~3~-({9-[2-(2-chlorophenyl)acetyl]-1-oxa-9-azaspiro[5.5]undec-4-yl}methyl)nicotinamide

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

SA64-1163

Molecular Formula

C24H28ClN3O3 (C24 H28 ClN3 O3)

Compound Name

N~3~-({9-[2-(2-chlorophenyl)acetyl]-1-oxa-9-azaspiro[5.5]undec-4-yl}methyl)nicotinamide

IUPAC name

N-({9-[2-(2-chlorophenyl)acetyl]-1-oxa-9-azaspiro[5.5]undecan-4-yl}methyl)pyridine-3-carboxamide

SMILES

O=C(Cc(cccc1)c1Cl)N(CC1)CCC11OCCC(CNC(c2cnccc2)=O)C1

InChI

InChI=1S/C24H28ClN3O3/c25-21-6-2-1-4-19(21)14-22(29)28-11-8-24(9-12-28)15-18(7-13-31-24)16-27-23(30)20-5-3-10-26-17-20/h1-6,10,17-18H,7-9,11-16H2,(H,27,30)/t18-/m1/s1

InChI Key

LEWQAGNJQDJEEO-GOSISDBHSA-N

MDL Number (MFCD)

MFCD32239539

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.96

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.678

Distribution Coefficient, logD

2.678

Water Solubility, LogSw

-3.47

Polar Surface Area

56.892

Acid Dissociation Constant (pKa)

12.95

Base Dissociation Constant (pKb)

3.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.83

SA64-1163 in Drug Discovery

Included in Screening Libraries

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 SA64-1163 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA64-1163?
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What is the minimum amount of SA64-1163 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA64-1163
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA64-1163
  • 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 SA64-1163 available by request