D750-0456 Screening compound: 2-[4-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)tetrahydro-2H-pyran-4-yl]-N-(4-phenoxyphenyl)acetamide

D750-0456 Screening compound: 2-[4-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)tetrahydro-2H-pyran-4-yl]-N-(4-phenoxyphenyl)acetamide
D750-0456 Screening compound: 2-[4-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)tetrahydro-2H-pyran-4-yl]-N-(4-phenoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D750-0456
2-[4-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)tetrahydro-2H-pyran-4-yl]-N-(4-phenoxyphenyl)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

D750-0456

Molecular Formula

C27H26N2O4 (C27 H26 N2 O4)

Compound Name

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

IUPAC name

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

SMILES

O=C(CC1(CCOCC1)N(Cc1c2cccc1)C2=O)Nc(cc1)ccc1Oc1ccccc1

InChI

InChI=1S/C27H26N2O4/c30-25(28-21-10-12-23(13-11-21)33-22-7-2-1-3-8-22)18-27(14-16-32-17-15-27)29-19-20-6-4-5-9-24(20)26(29)31/h1-13H,14-19H2,(H,28,30)

InChI Key

SYHLTWMNOWGMCD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32223403

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.51

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

4.509

Distribution Coefficient, logD

4.509

Water Solubility, LogSw

-4.59

Polar Surface Area

53.754

Acid Dissociation Constant (pKa)

11.92

Base Dissociation Constant (pKb)

1.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.93

D750-0456 in Drug Discovery

Included in Screening Libraries

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

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with D750-0456 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D750-0456?
Check Price and Availability of D750-0456, 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 D750-0456 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D750-0456
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D750-0456
  • 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 D750-0456 available by request