K623-0428 Screening compound: N-[5-[(ETHYL-3-METHYLANILINO)CARBONYL]-2-(6-OXO-7

K623-0428 Screening compound: N-[5-[(ETHYL-3-METHYLANILINO)CARBONYL]-2-(6-OXO-7
K623-0428 Screening compound: N-[5-[(ETHYL-3-METHYLANILINO)CARBONYL]-2-(6-OXO-7 alternative view

Chemical Structure Depiction of ChemDiv screening compound K623-0428
N-[5-[(ETHYL-3-METHYLANILINO)CARBONYL]-2-(6-OXO-7

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

K623-0428

Molecular Formula

C33H33N5O3 (C33 H33 N5 O3)

Compound Name

N-[5-[(ETHYL-3-METHYLANILINO)CARBONYL]-2-(6-OXO-7

IUPAC name

n/a

SMILES

CCN(C(c(cc1)cc(NC(c2ccncc2)=O)c1N(CC(C1)CN23)CC1C3=CC=CC2=O)=O)c1cc(C)ccc1

InChI

InChI=1S/C33H33N5O3/c1-3-37(27-7-4-6-22(2)16-27)33(41)25-10-11-30(28(18-25)35-32(40)24-12-14-34-15-13-24)36-19-23-17-26(21-36)29-8-5-9-31(39)38(29)20-23/h4-16,18,23,26H,3,17,19-21H2,1-2H3,(H,35,40)

InChI Key

PXRQQEMPMISJCE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02657081

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

547.66

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.766

Distribution Coefficient, logD

4.267

Water Solubility, LogSw

-4.38

Polar Surface Area

66.258

Acid Dissociation Constant (pKa)

7.07

Base Dissociation Constant (pKb)

2.35

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

10.00

K623-0428 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Nucleic Acid Ligands (8311 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Cyclic compounds
  • Cyclic compounds
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with K623-0428 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K623-0428?
Check Price and Availability of K623-0428, 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 K623-0428 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K623-0428
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K623-0428
  • 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 K623-0428 available by request