2332-0912 Screening compound: 5-benzyl-3-[4-(dimethylamino)phenyl]-2-phenyl-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione

2332-0912 Screening compound: 5-benzyl-3-[4-(dimethylamino)phenyl]-2-phenyl-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
2332-0912 Screening compound: 5-benzyl-3-[4-(dimethylamino)phenyl]-2-phenyl-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 2332-0912
5-benzyl-3-[4-(dimethylamino)phenyl]-2-phenyl-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione

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

2332-0912

Molecular Formula

C26H25N3O3 (C26 H25 N3 O3)

Compound Name

5-benzyl-3-[4-(dimethylamino)phenyl]-2-phenyl-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione

IUPAC name

5-benzyl-3-[4-(dimethylamino)phenyl]-2-phenyl-hexahydro-2H-pyrrolo[34-d][12]oxazole-46-dione

SMILES

CN(C)c1ccc(C(C2C(N3Cc4ccccc4)=O)N(c4ccccc4)OC2C3=O)cc1

InChI

InChI=1S/C26H25N3O3/c1-27(2)20-15-13-19(14-16-20)23-22-24(32-29(23)21-11-7-4-8-12-21)26(31)28(25(22)30)17-18-9-5-3-6-10-18/h3-16,22-24H,17H2,1-2H3

InChI Key

PFRSABFPMWBXNL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00523064

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.750

Distribution Coefficient, logD

3.746

Water Solubility, LogSw

-4.13

Polar Surface Area

47.050

Acid Dissociation Constant (pKa)

13.83

Base Dissociation Constant (pKb)

5.34

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

23.10

2332-0912 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 2332-0912 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2332-0912?
Check Price and Availability of 2332-0912, 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 2332-0912 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2332-0912
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2332-0912
  • 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 2332-0912 available by request