1950-0243 Screening compound: 3-(4-bromobenzoyl)-1,2-bis(propane-1-sulfonyl)indolizin-8-amine

1950-0243 Screening compound: 3-(4-bromobenzoyl)-1,2-bis(propane-1-sulfonyl)indolizin-8-amine
1950-0243 Screening compound: 3-(4-bromobenzoyl)-1,2-bis(propane-1-sulfonyl)indolizin-8-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 1950-0243
3-(4-bromobenzoyl)-1,2-bis(propane-1-sulfonyl)indolizin-8-amine

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

1950-0243

Molecular Formula

C21H23BrN2O5S2 (C21 H23 BrN2 O5 S2)

Compound Name

3-(4-bromobenzoyl)-1,2-bis(propane-1-sulfonyl)indolizin-8-amine

IUPAC name

3-(4-bromobenzoyl)-12-bis(propane-1-sulfonyl)indolizin-8-amine

SMILES

CCCS(c1c(C(c(cc2)ccc2Br)=O)n(cccc2N)c2c1S(CCC)(=O)=O)(=O)=O

InChI

InChI=1S/C21H23BrN2O5S2/c1-3-12-30(26,27)20-17-16(23)6-5-11-24(17)18(21(20)31(28,29)13-4-2)19(25)14-7-9-15(22)10-8-14/h5-11H,3-4,12-13,23H2,1-2H3

InChI Key

WKYFQYDZCBXJCQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01117989

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

527.46

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

3.064

Distribution Coefficient, logD

3.064

Water Solubility, LogSw

-3.24

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

28.60

1950-0243 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

CNS targets activity set (6557 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 1950-0243 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1950-0243?
Check Price and Availability of 1950-0243, 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 1950-0243 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1950-0243
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1950-0243
  • 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 1950-0243 available by request