8007-1103 Screening compound: ethyl 2-{[(9,10-dioxo-9,10-dihydro-2-anthracenyl)sulfonyl]amino}-3-(4-hydroxyphenyl)propanoate

8007-1103 Screening compound: ethyl 2-{[(9,10-dioxo-9,10-dihydro-2-anthracenyl)sulfonyl]amino}-3-(4-hydroxyphenyl)propanoate
8007-1103 Screening compound: ethyl 2-{[(9,10-dioxo-9,10-dihydro-2-anthracenyl)sulfonyl]amino}-3-(4-hydroxyphenyl)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-1103
ethyl 2-{[(9,10-dioxo-9,10-dihydro-2-anthracenyl)sulfonyl]amino}-3-(4-hydroxyphenyl)propanoate

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

8007-1103

Molecular Formula

C25H21NO7S (C25 H21 NO7 S)

Compound Name

ethyl 2-{[(9,10-dioxo-9,10-dihydro-2-anthracenyl)sulfonyl]amino}-3-(4-hydroxyphenyl)propanoate

IUPAC name

ethyl 2-(910-dioxo-910-dihydroanthracene-2-sulfonamido)-3-(4-hydroxyphenyl)propanoate

SMILES

CCOC(C(Cc(cc1)ccc1O)NS(c(cc1)cc(C(c2c3cccc2)=O)c1C3=O)(=O)=O)=O

InChI

InChI=1S/C25H21NO7S/c1-2-33-25(30)22(13-15-7-9-16(27)10-8-15)26-34(31,32)17-11-12-20-21(14-17)24(29)19-6-4-3-5-18(19)23(20)28/h3-12,14,22,26-27H,2,13H2,1H3/t22-/m0/s1

InChI Key

RVGBWMZVTMFDNE-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD00828422

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.51

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.032

Distribution Coefficient, logD

4.032

Water Solubility, LogSw

-4.20

Polar Surface Area

106.153

Acid Dissociation Constant (pKa)

10.14

Base Dissociation Constant (pKb)

-8.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.00

8007-1103 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 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 8007-1103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-1103?
Check Price and Availability of 8007-1103, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8007-1103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-1103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-1103
  • 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 8007-1103 available by request