D750-0464 Screening compound: N-cyclooctyl-2-[4-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)tetrahydro-2H-pyran-4-yl]acetamide

D750-0464 Screening compound: N-cyclooctyl-2-[4-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)tetrahydro-2H-pyran-4-yl]acetamide
D750-0464 Screening compound: N-cyclooctyl-2-[4-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)tetrahydro-2H-pyran-4-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D750-0464
N-cyclooctyl-2-[4-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)tetrahydro-2H-pyran-4-yl]acetamide

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

D750-0464

Molecular Formula

C23H32N2O3 (C23 H32 N2 O3)

Compound Name

N-cyclooctyl-2-[4-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)tetrahydro-2H-pyran-4-yl]acetamide

IUPAC name

N-cyclooctyl-2-[4-(1-oxo-23-dihydro-1H-isoindol-2-yl)oxan-4-yl]acetamide

SMILES

O=C(CC1(CCOCC1)N(Cc1c2cccc1)C2=O)NC1CCCCCCC1

InChI

InChI=1S/C23H32N2O3/c26-21(24-19-9-4-2-1-3-5-10-19)16-23(12-14-28-15-13-23)25-17-18-8-6-7-11-20(18)22(25)27/h6-8,11,19H,1-5,9-10,12-17H2,(H,24,26)

InChI Key

NDVDBQMNXBUEFJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32009130

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.764

Distribution Coefficient, logD

3.764

Water Solubility, LogSw

-4.02

Polar Surface Area

48.385

Acid Dissociation Constant (pKa)

14.36

Base Dissociation Constant (pKb)

3.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.22

D750-0464 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D750-0464 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D750-0464?
Check Price and Availability of D750-0464, 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 D750-0464 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D750-0464
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D750-0464
  • 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 D750-0464 available by request