8009-9940 Screening compound: [8-amino-1,2-bis(propylsulfonyl)-3-indolizinyl](phenyl)methanone

8009-9940 Screening compound: [8-amino-1,2-bis(propylsulfonyl)-3-indolizinyl](phenyl)methanone
8009-9940 Screening compound: [8-amino-1,2-bis(propylsulfonyl)-3-indolizinyl](phenyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-9940
[8-amino-1,2-bis(propylsulfonyl)-3-indolizinyl](phenyl)methanone

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

8009-9940

Molecular Formula

C21H24N2O5S2 (C21 H24 N2 O5 S2)

Compound Name

[8-amino-1,2-bis(propylsulfonyl)-3-indolizinyl](phenyl)methanone

IUPAC name

3-benzoyl-12-bis(propane-1-sulfonyl)indolizin-8-amine

SMILES

CCCS(c1c(C(c2ccccc2)=O)n(cccc2N)c2c1S(CCC)(=O)=O)(=O)=O

InChI

InChI=1S/C21H24N2O5S2/c1-3-13-29(25,26)20-17-16(22)11-8-12-23(17)18(21(20)30(27,28)14-4-2)19(24)15-9-6-5-7-10-15/h5-12H,3-4,13-14,22H2,1-2H3

InChI Key

SRRRDRKFTABVFB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00689819

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.56

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.125

Distribution Coefficient, logD

2.125

Water Solubility, LogSw

-2.44

Polar Surface Area

90.108

Acid Dissociation Constant (pKa)

19.18

Base Dissociation Constant (pKb)

3.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.57

8009-9940 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8009-9940 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-9940?
Check Price and Availability of 8009-9940, 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 8009-9940 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-9940
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-9940
  • 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 8009-9940 available by request