Y070-1148 Screening compound: ethyl 2-({1-[(ethoxycarbonyl)amino]-2-oxo-2-phenylethyl}amino)-4-phenylthiophene-3-carboxylate

Y070-1148 Screening compound: ethyl 2-({1-[(ethoxycarbonyl)amino]-2-oxo-2-phenylethyl}amino)-4-phenylthiophene-3-carboxylate
Y070-1148 Screening compound: ethyl 2-({1-[(ethoxycarbonyl)amino]-2-oxo-2-phenylethyl}amino)-4-phenylthiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-1148
ethyl 2-({1-[(ethoxycarbonyl)amino]-2-oxo-2-phenylethyl}amino)-4-phenylthiophene-3-carboxylate

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

Y070-1148

Molecular Formula

C24H24N2O5S (C24 H24 N2 O5 S)

Compound Name

ethyl 2-({1-[(ethoxycarbonyl)amino]-2-oxo-2-phenylethyl}amino)-4-phenylthiophene-3-carboxylate

IUPAC name

ethyl 2-({1-[(ethoxycarbonyl)amino]-2-oxo-2-phenylethyl}amino)-4-phenylthiophene-3-carboxylate

SMILES

CCOC(c1c(NC(C(c2ccccc2)=O)NC(OCC)=O)scc1-c1ccccc1)=O

InChI

InChI=1S/C24H24N2O5S/c1-3-30-23(28)19-18(16-11-7-5-8-12-16)15-32-22(19)25-21(26-24(29)31-4-2)20(27)17-13-9-6-10-14-17/h5-15,21,25H,3-4H2,1-2H3,(H,26,29)/t21-/m1/s1

InChI Key

MZCLRTVFFQGRGI-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD03463648

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.646

Distribution Coefficient, logD

4.646

Water Solubility, LogSw

-4.49

Polar Surface Area

75.546

Acid Dissociation Constant (pKa)

11.41

Base Dissociation Constant (pKb)

-6.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.80

Y070-1148 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y070-1148 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-1148?
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What is the minimum amount of Y070-1148 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-1148
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-1148
  • 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 Y070-1148 available by request