G554-0540 Screening compound: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-(pyrrolidin-1-yl)-3-(pyrrolidine-1-sulfonyl)benzamide

G554-0540 Screening compound: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-(pyrrolidin-1-yl)-3-(pyrrolidine-1-sulfonyl)benzamide
G554-0540 Screening compound: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-(pyrrolidin-1-yl)-3-(pyrrolidine-1-sulfonyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G554-0540
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-(pyrrolidin-1-yl)-3-(pyrrolidine-1-sulfonyl)benzamide

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

G554-0540

Molecular Formula

C26H32N4O4S (C26 H32 N4 O4 S)

Compound Name

N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-(pyrrolidin-1-yl)-3-(pyrrolidine-1-sulfonyl)benzamide

IUPAC name

N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-(pyrrolidin-1-yl)-3-(pyrrolidine-1-sulfonyl)benzamide

SMILES

COc(cc1)cc2c1[nH]cc2CCNC(c(cc1)cc(S(N2CCCC2)(=O)=O)c1N1CCCC1)=O

InChI

InChI=1S/C26H32N4O4S/c1-34-21-7-8-23-22(17-21)20(18-28-23)10-11-27-26(31)19-6-9-24(29-12-2-3-13-29)25(16-19)35(32,33)30-14-4-5-15-30/h6-9,16-18,28H,2-5,10-15H2,1H3,(H,27,31)

InChI Key

HNVLKQLSQLQOEL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15019458

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.63

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.518

Distribution Coefficient, logD

3.518

Water Solubility, LogSw

-3.97

Polar Surface Area

77.502

Acid Dissociation Constant (pKa)

12.15

Base Dissociation Constant (pKb)

-1.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.30

G554-0540 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G554-0540 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G554-0540?
Check Price and Availability of G554-0540, 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 G554-0540 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G554-0540
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G554-0540
  • 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 G554-0540 available by request