K807-4971 Screening compound: N-(4-{[4-(2,5-dioxopyrrolidin-1-yl)-2-nitrophenyl]amino}phenyl)acetamide

K807-4971 Screening compound: N-(4-{[4-(2,5-dioxopyrrolidin-1-yl)-2-nitrophenyl]amino}phenyl)acetamide
K807-4971 Screening compound: N-(4-{[4-(2,5-dioxopyrrolidin-1-yl)-2-nitrophenyl]amino}phenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K807-4971
N-(4-{[4-(2,5-dioxopyrrolidin-1-yl)-2-nitrophenyl]amino}phenyl)acetamide

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

K807-4971

Molecular Formula

C18H16N4O5 (C18 H16 N4 O5)

Compound Name

N-(4-{[4-(2,5-dioxopyrrolidin-1-yl)-2-nitrophenyl]amino}phenyl)acetamide

IUPAC name

N-(4-{[4-(25-dioxopyrrolidin-1-yl)-2-nitrophenyl]amino}phenyl)acetamide

SMILES

CC(Nc(cc1)ccc1Nc(ccc(N(C(CC1)=O)C1=O)c1)c1[N+]([O-])=O)=O

InChI

InChI=1S/C18H16N4O5/c1-11(23)19-12-2-4-13(5-3-12)20-15-7-6-14(10-16(15)22(26)27)21-17(24)8-9-18(21)25/h2-7,10,20H,8-9H2,1H3,(H,19,23)

InChI Key

JOAJOIOLIJZVPP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03452373

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.35

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.448

Distribution Coefficient, logD

1.448

Water Solubility, LogSw

-2.40

Polar Surface Area

94.264

Acid Dissociation Constant (pKa)

13.08

Base Dissociation Constant (pKb)

1.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

K807-4971 in Drug Discovery

Included in Screening Libraries

Cysteine Proteases Inhibitors Library (7839 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Cardiovascular
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with K807-4971 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K807-4971?
Check Price and Availability of K807-4971, 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 K807-4971 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K807-4971
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K807-4971
  • 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 K807-4971 available by request