Y030-8109 Screening compound: methyl 2-[(3-chloro-1-benzothiophen-2-yl)formamido]acetate

Y030-8109 Screening compound: methyl 2-[(3-chloro-1-benzothiophen-2-yl)formamido]acetate
Y030-8109 Screening compound: methyl 2-[(3-chloro-1-benzothiophen-2-yl)formamido]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-8109
methyl 2-[(3-chloro-1-benzothiophen-2-yl)formamido]acetate

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

Y030-8109

Molecular Formula

C12H10ClNO3S (C12 H10 ClNO3 S)

Compound Name

methyl 2-[(3-chloro-1-benzothiophen-2-yl)formamido]acetate

IUPAC name

methyl 2-[(3-chloro-1-benzothiophen-2-yl)formamido]acetate

SMILES

COC(CNC(c(sc1c2cccc1)c2Cl)=O)=O

InChI

InChI=1S/C12H10ClNO3S/c1-17-9(15)6-14-12(16)11-10(13)7-4-2-3-5-8(7)18-11/h2-5H,6H2,1H3,(H,14,16)

InChI Key

LCNHTTSPODJGTO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03638834

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

283.74

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.766

Distribution Coefficient, logD

2.766

Water Solubility, LogSw

-3.63

Polar Surface Area

46.249

Acid Dissociation Constant (pKa)

12.25

Base Dissociation Constant (pKb)

-2.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

Y030-8109 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y030-8109 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-8109?
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What is the minimum amount of Y030-8109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-8109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-8109
  • 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 Y030-8109 available by request