E199-0051 Screening compound: ethyl 1-[3-(2-amino-5-bromopyridine-3-sulfonamido)propanoyl]piperidine-4-carboxylate

E199-0051 Screening compound: ethyl 1-[3-(2-amino-5-bromopyridine-3-sulfonamido)propanoyl]piperidine-4-carboxylate
E199-0051 Screening compound: ethyl 1-[3-(2-amino-5-bromopyridine-3-sulfonamido)propanoyl]piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound E199-0051
ethyl 1-[3-(2-amino-5-bromopyridine-3-sulfonamido)propanoyl]piperidine-4-carboxylate

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

E199-0051

Molecular Formula

C16H23BrN4O5S (C16 H23 BrN4 O5 S)

Compound Name

ethyl 1-[3-(2-amino-5-bromopyridine-3-sulfonamido)propanoyl]piperidine-4-carboxylate

IUPAC name

ethyl 1-[3-(2-amino-5-bromopyridine-3-sulfonamido)propanoyl]piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(CCNS(c1cc(Br)cnc1N)(=O)=O)=O)=O

InChI

InChI=1S/C16H23BrN4O5S/c1-2-26-16(23)11-4-7-21(8-5-11)14(22)3-6-20-27(24,25)13-9-12(17)10-19-15(13)18/h9-11,20H,2-8H2,1H3,(H2,18,19)

InChI Key

AQJHGJCOGUMRJH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14845121

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.35

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.866

Distribution Coefficient, logD

0.866

Water Solubility, LogSw

-2.37

Polar Surface Area

108.818

Acid Dissociation Constant (pKa)

10.35

Base Dissociation Constant (pKb)

-0.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.30

E199-0051 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
  • Proteases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with E199-0051 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E199-0051?
Check Price and Availability of E199-0051, 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 E199-0051 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E199-0051
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E199-0051
  • 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 E199-0051 available by request