8010-2892 Screening compound: 3'-(4-ethoxyphenyl)-1-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5'-methyl-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidine]-2,4'-dione

8010-2892 Screening compound: 3'-(4-ethoxyphenyl)-1-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5'-methyl-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidine]-2,4'-dione
8010-2892 Screening compound: 3'-(4-ethoxyphenyl)-1-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5'-methyl-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidine]-2,4'-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-2892
3'-(4-ethoxyphenyl)-1-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5'-methyl-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidine]-2,4'-dione

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

8010-2892

Molecular Formula

C30H31FN4O3S (C30 H31 FN4 O3 S)

Compound Name

3'-(4-ethoxyphenyl)-1-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5'-methyl-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidine]-2,4'-dione

IUPAC name

3'-(4-ethoxyphenyl)-1-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5'-methyl-12-dihydrospiro[indole-32'-[13]thiazolidine]-24'-dione

SMILES

CCOc(cc1)ccc1N(C(c(cccc1)c1N1CN(CC2)CCN2c(cc2)ccc2F)(C1=O)SC1C)C1=O

InChI

InChI=1S/C30H31FN4O3S/c1-3-38-25-14-12-24(13-15-25)35-28(36)21(2)39-30(35)26-6-4-5-7-27(26)34(29(30)37)20-32-16-18-33(19-17-32)23-10-8-22(31)9-11-23/h4-15,21H,3,16-20H2,1-2H3

InChI Key

YLEGDBTXHWJUPB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01872870

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

546.67

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.096

Distribution Coefficient, logD

4.804

Water Solubility, LogSw

-4.88

Polar Surface Area

46.568

Acid Dissociation Constant (pKa)

11.24

Base Dissociation Constant (pKb)

7.38

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

33.30

8010-2892 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8010-2892 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-2892?
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What is the minimum amount of 8010-2892 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-2892
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-2892
  • 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 8010-2892 available by request