E897-0435 Screening compound: 2-[3'-(3,4-dimethylphenyl)-2,4'-dioxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidin]-1-yl]-N-[4-(propan-2-yl)phenyl]acetamide

E897-0435 Screening compound: 2-[3'-(3,4-dimethylphenyl)-2,4'-dioxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidin]-1-yl]-N-[4-(propan-2-yl)phenyl]acetamide
E897-0435 Screening compound: 2-[3'-(3,4-dimethylphenyl)-2,4'-dioxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidin]-1-yl]-N-[4-(propan-2-yl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E897-0435
2-[3'-(3,4-dimethylphenyl)-2,4'-dioxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidin]-1-yl]-N-[4-(propan-2-yl)phenyl]acetamide

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

E897-0435

Molecular Formula

C29H29N3O3S (C29 H29 N3 O3 S)

Compound Name

2-[3'-(3,4-dimethylphenyl)-2,4'-dioxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidin]-1-yl]-N-[4-(propan-2-yl)phenyl]acetamide

IUPAC name

2-[3'-(34-dimethylphenyl)-24'-dioxo-12-dihydrospiro[indole-32'-[13]thiazolidin]-1-yl]-N-[4-(propan-2-yl)phenyl]acetamide

SMILES

CC(C)c(cc1)ccc1NC(CN(C(C1(N2c3cc(C)c(C)cc3)SCC2=O)=O)c2c1cccc2)=O

InChI

InChI=1S/C29H29N3O3S/c1-18(2)21-10-12-22(13-11-21)30-26(33)16-31-25-8-6-5-7-24(25)29(28(31)35)32(27(34)17-36-29)23-14-9-19(3)20(4)15-23/h5-15,18H,16-17H2,1-4H3,(H,30,33)/t29-/m0/s1

InChI Key

YIOWYWBCNLUSTO-LJAQVGFWSA-N

MDL Number (MFCD)

MFCD14926283

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.63

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.153

Distribution Coefficient, logD

6.153

Water Solubility, LogSw

-5.47

Polar Surface Area

54.185

Acid Dissociation Constant (pKa)

12.39

Base Dissociation Constant (pKb)

1.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.60

E897-0435 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with E897-0435 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E897-0435?
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What is the minimum amount of E897-0435 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E897-0435
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E897-0435
  • 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 E897-0435 available by request