Y031-4216 Screening compound: N-(3-bromophenyl)-1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carboxamide

Y031-4216 Screening compound: N-(3-bromophenyl)-1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carboxamide
Y031-4216 Screening compound: N-(3-bromophenyl)-1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-4216
N-(3-bromophenyl)-1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carboxamide

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

Y031-4216

Molecular Formula

C19H18BrFN2O2 (C19 H18 BrFN2 O2)

Compound Name

N-(3-bromophenyl)-1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carboxamide

IUPAC name

N-(3-bromophenyl)-1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carboxamide

SMILES

O=C(C(C1)CN(CCc(cc2)ccc2F)C1=O)Nc1cccc(Br)c1

InChI

InChI=1S/C19H18BrFN2O2/c20-15-2-1-3-17(11-15)22-19(25)14-10-18(24)23(12-14)9-8-13-4-6-16(21)7-5-13/h1-7,11,14H,8-10,12H2,(H,22,25)/t14-/m0/s1

InChI Key

GMPNEWUKZLXRBH-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD07401037

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.27

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.938

Distribution Coefficient, logD

2.937

Water Solubility, LogSw

-3.28

Polar Surface Area

40.504

Acid Dissociation Constant (pKa)

10.05

Base Dissociation Constant (pKb)

-1.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with Y031-4216 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-4216?
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What is the minimum amount of Y031-4216 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-4216
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-4216
  • 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 Y031-4216 available by request