8010-1098 Screening compound: ethyl 2-[2,3,4,5-tetrakis(acetyloxy)pentanamido]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

8010-1098 Screening compound: ethyl 2-[2,3,4,5-tetrakis(acetyloxy)pentanamido]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate
8010-1098 Screening compound: ethyl 2-[2,3,4,5-tetrakis(acetyloxy)pentanamido]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-1098
ethyl 2-[2,3,4,5-tetrakis(acetyloxy)pentanamido]-4H,5H,6H-cyclopenta[b]thiophene-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

8010-1098

Molecular Formula

C23H29NO11S (C23 H29 NO11 S)

Compound Name

ethyl 2-[2,3,4,5-tetrakis(acetyloxy)pentanamido]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

IUPAC name

ethyl 2-[2345-tetrakis(acetyloxy)pentanamido]-4H5H6H-cyclopenta[b]thiophene-3-carboxylate

SMILES

CCOC(c1c(NC(C(C(C(COC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)=O)sc2c1CCC2)=O

InChI

InChI=1S/C23H29NO11S/c1-6-31-23(30)18-15-8-7-9-17(15)36-22(18)24-21(29)20(35-14(5)28)19(34-13(4)27)16(33-12(3)26)10-32-11(2)25/h16,19-20H,6-10H2,1-5H3,(H,24,29)

InChI Key

XUTMLUPUYFFEIL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01857583

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

527.55

Hydrogen Bond Acceptors Count

17.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

17.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

2.037

Distribution Coefficient, logD

-0.796

Water Solubility, LogSw

-2.51

Polar Surface Area

127.085

Acid Dissociation Constant (pKa)

4.57

Base Dissociation Constant (pKb)

-5.35

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

56.50

8010-1098 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8010-1098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-1098?
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What is the minimum amount of 8010-1098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-1098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-1098
  • 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 8010-1098 available by request