Y080-1744 Screening compound: 4-(5-chloro-1,3-benzoxazol-2-yl)-1-phenyl-2-pyrrolidinone

Y080-1744 Screening compound: 4-(5-chloro-1,3-benzoxazol-2-yl)-1-phenyl-2-pyrrolidinone
Y080-1744 Screening compound: 4-(5-chloro-1,3-benzoxazol-2-yl)-1-phenyl-2-pyrrolidinone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-1744
4-(5-chloro-1,3-benzoxazol-2-yl)-1-phenyl-2-pyrrolidinone

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

Y080-1744

Molecular Formula

C17H13ClN2O2 (C17 H13 ClN2 O2)

Compound Name

4-(5-chloro-1,3-benzoxazol-2-yl)-1-phenyl-2-pyrrolidinone

IUPAC name

4-(5-chloro-13-benzoxazol-2-yl)-1-phenylpyrrolidin-2-one

SMILES

O=C(CC(C1)c2nc(cc(cc3)Cl)c3o2)N1c1ccccc1

InChI

InChI=1S/C17H13ClN2O2/c18-12-6-7-15-14(9-12)19-17(22-15)11-8-16(21)20(10-11)13-4-2-1-3-5-13/h1-7,9,11H,8,10H2/t11-/m0/s1

InChI Key

LKRJORGMWCRTQT-NSHDSACASA-N

MDL Number (MFCD)

MFCD23699722

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.76

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.795

Distribution Coefficient, logD

3.794

Water Solubility, LogSw

-4.25

Polar Surface Area

33.799

Acid Dissociation Constant (pKa)

11.48

Base Dissociation Constant (pKb)

-3.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

17.65

Y080-1744 in Drug Discovery

Included in Screening Libraries

GABA Library (7115 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y080-1744 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-1744?
Check Price and Availability of Y080-1744, 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 Y080-1744 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-1744
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-1744
  • 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 Y080-1744 available by request