Y030-7064 Screening compound: 2-ethyl-N-[4-(pyrrolidine-1-sulfonyl)phenyl]hexanamide

Y030-7064 Screening compound: 2-ethyl-N-[4-(pyrrolidine-1-sulfonyl)phenyl]hexanamide
Y030-7064 Screening compound: 2-ethyl-N-[4-(pyrrolidine-1-sulfonyl)phenyl]hexanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-7064
2-ethyl-N-[4-(pyrrolidine-1-sulfonyl)phenyl]hexanamide

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

Y030-7064

Molecular Formula

C18H28N2O3S (C18 H28 N2 O3 S)

Compound Name

2-ethyl-N-[4-(pyrrolidine-1-sulfonyl)phenyl]hexanamide

IUPAC name

2-ethyl-N-[4-(pyrrolidine-1-sulfonyl)phenyl]hexanamide

SMILES

CCCCC(CC)C(Nc(cc1)ccc1S(N1CCCC1)(=O)=O)=O

InChI

InChI=1S/C18H28N2O3S/c1-3-5-8-15(4-2)18(21)19-16-9-11-17(12-10-16)24(22,23)20-13-6-7-14-20/h9-12,15H,3-8,13-14H2,1-2H3,(H,19,21)/t15-/m0/s1

InChI Key

JXENVZUAVATLRL-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD03351938

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.849

Distribution Coefficient, logD

3.846

Water Solubility, LogSw

-3.81

Polar Surface Area

55.678

Acid Dissociation Constant (pKa)

9.63

Base Dissociation Constant (pKb)

-1.80

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.10

Y030-7064 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with Y030-7064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-7064?
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What is the minimum amount of Y030-7064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-7064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-7064
  • 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 Y030-7064 available by request