6284-2520 Screening compound: (5Z)-3-ethyl-5-({7-ethyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-indol-3-yl}methylidene)-2-sulfanylideneimidazolidin-4-one

6284-2520 Screening compound: (5Z)-3-ethyl-5-({7-ethyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-indol-3-yl}methylidene)-2-sulfanylideneimidazolidin-4-one
6284-2520 Screening compound: (5Z)-3-ethyl-5-({7-ethyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-indol-3-yl}methylidene)-2-sulfanylideneimidazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6284-2520
(5Z)-3-ethyl-5-({7-ethyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-indol-3-yl}methylidene)-2-sulfanylideneimidazolidin-4-one

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

6284-2520

Molecular Formula

C22H26N4O2S (C22 H26 N4 O2 S)

Compound Name

(5Z)-3-ethyl-5-({7-ethyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-indol-3-yl}methylidene)-2-sulfanylideneimidazolidin-4-one

IUPAC name

(5Z)-3-ethyl-5-({7-ethyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-indol-3-yl}methylidene)-2-sulfanylideneimidazolidin-4-one

SMILES

CCc1cccc2c1n(CC(N1CCCC1)=O)cc2/C=C(/C(N1CC)=O)\NC1=S

InChI

InChI=1S/C22H26N4O2S/c1-3-15-8-7-9-17-16(12-18-21(28)26(4-2)22(29)23-18)13-25(20(15)17)14-19(27)24-10-5-6-11-24/h7-9,12-13H,3-6,10-11,14H2,1-2H3,(H,23,29)

InChI Key

IWXFEKAOPQLKGQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05149585

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.289

Distribution Coefficient, logD

3.288

Water Solubility, LogSw

-3.25

Polar Surface Area

45.771

Acid Dissociation Constant (pKa)

10.37

Base Dissociation Constant (pKb)

0.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

6284-2520 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6284-2520 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6284-2520?
Check Price and Availability of 6284-2520, 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 6284-2520 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6284-2520
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6284-2520
  • 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 6284-2520 available by request