8015-3070 Screening compound: 1-benzyl-3'-[2-(methylsulfanyl)ethyl]-5'-phenyl-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

8015-3070 Screening compound: 1-benzyl-3'-[2-(methylsulfanyl)ethyl]-5'-phenyl-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
8015-3070 Screening compound: 1-benzyl-3'-[2-(methylsulfanyl)ethyl]-5'-phenyl-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 8015-3070
1-benzyl-3'-[2-(methylsulfanyl)ethyl]-5'-phenyl-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

8015-3070

Molecular Formula

C29H27N3O3S (C29 H27 N3 O3 S)

Compound Name

1-benzyl-3'-[2-(methylsulfanyl)ethyl]-5'-phenyl-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

1-benzyl-3'-[2-(methylsulfanyl)ethyl]-5'-phenyl-123'3'a4'5'6'6'a-octahydro-2'H-spiro[indole-31'-pyrrolo[34-c]pyrrole]-24'6'-trione

SMILES

CSCCC(C(C1C(N2c3ccccc3)=O)C2=O)NC1(c(cccc1)c1N1Cc2ccccc2)C1=O

InChI

InChI=1S/C29H27N3O3S/c1-36-17-16-22-24-25(27(34)32(26(24)33)20-12-6-3-7-13-20)29(30-22)21-14-8-9-15-23(21)31(28(29)35)18-19-10-4-2-5-11-19/h2-15,22,24-25,30H,16-18H2,1H3

InChI Key

ASANFQYZKSHHKR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04060537

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.62

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.580

Distribution Coefficient, logD

3.580

Water Solubility, LogSw

-3.99

Polar Surface Area

58.004

Acid Dissociation Constant (pKa)

14.38

Base Dissociation Constant (pKb)

4.27

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

27.60

8015-3070 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with 8015-3070 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-3070?
Check Price and Availability of 8015-3070, 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 8015-3070 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-3070
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-3070
  • 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 8015-3070 available by request