C092-0029 Screening compound: N-ethyl-1-[(2-hydroxyethyl)amino]-N-(4-methoxyphenyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide

C092-0029 Screening compound: N-ethyl-1-[(2-hydroxyethyl)amino]-N-(4-methoxyphenyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
C092-0029 Screening compound: N-ethyl-1-[(2-hydroxyethyl)amino]-N-(4-methoxyphenyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C092-0029
N-ethyl-1-[(2-hydroxyethyl)amino]-N-(4-methoxyphenyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide

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

C092-0029

Molecular Formula

C26H24N2O5 (C26 H24 N2 O5)

Compound Name

N-ethyl-1-[(2-hydroxyethyl)amino]-N-(4-methoxyphenyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide

IUPAC name

N-ethyl-1-[(2-hydroxyethyl)amino]-N-(4-methoxyphenyl)-910-dioxo-910-dihydroanthracene-2-carboxamide

SMILES

CCN(C(c(c(NCCO)c1C(c2c3cccc2)=O)ccc1C3=O)=O)c(cc1)ccc1OC

InChI

InChI=1S/C26H24N2O5/c1-3-28(16-8-10-17(33-2)11-9-16)26(32)21-13-12-20-22(23(21)27-14-15-29)25(31)19-7-5-4-6-18(19)24(20)30/h4-13,27,29H,3,14-15H2,1-2H3

InChI Key

JXBMQULMMYVCLD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14718929

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.049

Distribution Coefficient, logD

4.049

Water Solubility, LogSw

-4.34

Polar Surface Area

74.679

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

-1.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

C092-0029 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C092-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C092-0029?
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What is the minimum amount of C092-0029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C092-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C092-0029
  • 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 C092-0029 available by request