8015-3093 Screening compound: 5'-butyl-3'-(2-methylpropyl)-1-(prop-2-en-1-yl)-1,2,3',3'a,4',5',6',6'a-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'-trione

8015-3093 Screening compound: 5'-butyl-3'-(2-methylpropyl)-1-(prop-2-en-1-yl)-1,2,3',3'a,4',5',6',6'a-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'-trione
8015-3093 Screening compound: 5'-butyl-3'-(2-methylpropyl)-1-(prop-2-en-1-yl)-1,2,3',3'a,4',5',6',6'a-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-3093
5'-butyl-3'-(2-methylpropyl)-1-(prop-2-en-1-yl)-1,2,3',3'a,4',5',6',6'a-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'-trione

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

8015-3093

Molecular Formula

C24H31N3O3 (C24 H31 N3 O3)

Compound Name

5'-butyl-3'-(2-methylpropyl)-1-(prop-2-en-1-yl)-1,2,3',3'a,4',5',6',6'a-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'-trione

IUPAC name

5'-butyl-3'-(2-methylpropyl)-1-(prop-2-en-1-yl)-123'3'a4'5'6'6'a-octahydro-2'H-spiro[indole-31'-pyrrolo[34-c]pyrrole]-24'6'-trione

SMILES

CCCCN(C(C1C2C(c(cccc3)c3N3CC=C)(C3=O)NC1CC(C)C)=O)C2=O

InChI

InChI=1S/C24H31N3O3/c1-5-7-13-27-21(28)19-17(14-15(3)4)25-24(20(19)22(27)29)16-10-8-9-11-18(16)26(12-6-2)23(24)30/h6,8-11,15,17,19-20,25H,2,5,7,12-14H2,1,3-4H3

InChI Key

CCPFXTOFIDHMBG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04060556

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.53

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.426

Distribution Coefficient, logD

3.424

Water Solubility, LogSw

-3.90

Polar Surface Area

59.115

Acid Dissociation Constant (pKa)

16.72

Base Dissociation Constant (pKb)

5.23

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

54.20

8015-3093 in Drug Discovery

Included in Screening Libraries

Cysteine Proteases Inhibitors Library (7839 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Akt-Targeted Library (14764 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Cardiovascular
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Proteases
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with 8015-3093 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-3093?
Check Price and Availability of 8015-3093, 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 8015-3093 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-3093
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-3093
  • 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 8015-3093 available by request