Y031-3855 Screening compound: N-{2-[(3-ethoxypropyl)carbamoyl]phenyl}-1-(2-methylphenyl)-5-oxopyrrolidine-3-carboxamide

Y031-3855 Screening compound: N-{2-[(3-ethoxypropyl)carbamoyl]phenyl}-1-(2-methylphenyl)-5-oxopyrrolidine-3-carboxamide
Y031-3855 Screening compound: N-{2-[(3-ethoxypropyl)carbamoyl]phenyl}-1-(2-methylphenyl)-5-oxopyrrolidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-3855
N-{2-[(3-ethoxypropyl)carbamoyl]phenyl}-1-(2-methylphenyl)-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

Y031-3855

Molecular Formula

C24H29N3O4 (C24 H29 N3 O4)

Compound Name

N-{2-[(3-ethoxypropyl)carbamoyl]phenyl}-1-(2-methylphenyl)-5-oxopyrrolidine-3-carboxamide

IUPAC name

N-{2-[(3-ethoxypropyl)carbamoyl]phenyl}-1-(2-methylphenyl)-5-oxopyrrolidine-3-carboxamide

SMILES

CCOCCCNC(c(cccc1)c1NC(C(CC1=O)CN1c1c(C)cccc1)=O)=O

InChI

InChI=1S/C24H29N3O4/c1-3-31-14-8-13-25-24(30)19-10-5-6-11-20(19)26-23(29)18-15-22(28)27(16-18)21-12-7-4-9-17(21)2/h4-7,9-12,18H,3,8,13-16H2,1-2H3,(H,25,30)(H,26,29)/t18-/m1/s1

InChI Key

VWJMQDJACJAHTK-GOSISDBHSA-N

MDL Number (MFCD)

MFCD08090357

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.460

Distribution Coefficient, logD

2.450

Water Solubility, LogSw

-2.91

Polar Surface Area

71.585

Acid Dissociation Constant (pKa)

9.02

Base Dissociation Constant (pKb)

-2.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

Y031-3855 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y031-3855 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-3855?
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What is the minimum amount of Y031-3855 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-3855
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-3855
  • 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 Y031-3855 available by request