Y031-4723 Screening compound: N-{2-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl}-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxamide

Y031-4723 Screening compound: N-{2-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl}-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
Y031-4723 Screening compound: N-{2-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl}-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-4723
N-{2-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl}-1-(4-ethylphenyl)-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

Y031-4723

Molecular Formula

C24H25N5O3S (C24 H25 N5 O3 S)

Compound Name

N-{2-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl}-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxamide

IUPAC name

N-{2-[(5-ethyl-134-thiadiazol-2-yl)carbamoyl]phenyl}-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxamide

SMILES

CCc1nnc(NC(c(cccc2)c2NC(C(CC2=O)CN2c2ccc(CC)cc2)=O)=O)s1

InChI

InChI=1S/C24H25N5O3S/c1-3-15-9-11-17(12-10-15)29-14-16(13-21(29)30)22(31)25-19-8-6-5-7-18(19)23(32)26-24-28-27-20(4-2)33-24/h5-12,16H,3-4,13-14H2,1-2H3,(H,25,31)(H,26,28,32)/t16-/m0/s1

InChI Key

QJOCAKVUXXTLIX-INIZCTEOSA-N

MDL Number (MFCD)

MFCD08091950

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.740

Distribution Coefficient, logD

3.501

Water Solubility, LogSw

-3.92

Polar Surface Area

86.513

Acid Dissociation Constant (pKa)

7.54

Base Dissociation Constant (pKb)

-1.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.20

Y031-4723 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with Y031-4723 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-4723?
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What is the minimum amount of Y031-4723 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-4723
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-4723
  • 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 Y031-4723 available by request