P633-0004 Screening compound: ethyl 4-{1H-pyrrolo[2,3-b]pyridine-3-sulfonamido}benzoate

P633-0004 Screening compound: ethyl 4-{1H-pyrrolo[2,3-b]pyridine-3-sulfonamido}benzoate
P633-0004 Screening compound: ethyl 4-{1H-pyrrolo[2,3-b]pyridine-3-sulfonamido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound P633-0004
ethyl 4-{1H-pyrrolo[2,3-b]pyridine-3-sulfonamido}benzoate

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

P633-0004

Molecular Formula

C16H15N3O4S (C16 H15 N3 O4 S)

Compound Name

ethyl 4-{1H-pyrrolo[2,3-b]pyridine-3-sulfonamido}benzoate

IUPAC name

ethyl 4-{1H-pyrrolo[23-b]pyridine-3-sulfonamido}benzoate

SMILES

CCOC(c(cc1)ccc1NS(c1c[nH]c2c1cccn2)(=O)=O)=O

InChI

InChI=1S/C16H15N3O4S/c1-2-23-16(20)11-5-7-12(8-6-11)19-24(21,22)14-10-18-15-13(14)4-3-9-17-15/h3-10,19H,2H2,1H3,(H,17,18)

InChI Key

NKSYJYFVAXBAGG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13570050

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.38

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.750

Distribution Coefficient, logD

2.330

Water Solubility, LogSw

-3.08

Polar Surface Area

81.886

Acid Dissociation Constant (pKa)

7.19

Base Dissociation Constant (pKb)

3.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

P633-0004 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anticancer Library (62698 compounds)

Antiviral Library (67538 compounds)

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

Hsp90-Targeted Library (11355 compounds)

SH2 Library (10483 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with P633-0004 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P633-0004?
Check Price and Availability of P633-0004, 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 P633-0004 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P633-0004
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P633-0004
  • 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 P633-0004 available by request