D395-0133 Screening compound: N-[2-(4-{[(3-chlorophenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-4-methylphenyl]propanamide

D395-0133 Screening compound: N-[2-(4-{[(3-chlorophenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-4-methylphenyl]propanamide
D395-0133 Screening compound: N-[2-(4-{[(3-chlorophenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-4-methylphenyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D395-0133
N-[2-(4-{[(3-chlorophenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-4-methylphenyl]propanamide

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

D395-0133

Molecular Formula

C26H23ClN4O3 (C26 H23 ClN4 O3)

Compound Name

N-[2-(4-{[(3-chlorophenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-4-methylphenyl]propanamide

IUPAC name

N-[2-(4-{[(3-chlorophenyl)carbamoyl]methyl}-3-oxo-34-dihydroquinoxalin-2-yl)-4-methylphenyl]propanamide

SMILES

CCC(Nc(ccc(C)c1)c1C1=Nc(cccc2)c2N(CC(Nc2cccc(Cl)c2)=O)C1=O)=O

InChI

InChI=1S/C26H23ClN4O3/c1-3-23(32)29-20-12-11-16(2)13-19(20)25-26(34)31(22-10-5-4-9-21(22)30-25)15-24(33)28-18-8-6-7-17(27)14-18/h4-14H,3,15H2,1-2H3,(H,28,33)(H,29,32)

InChI Key

UOGKNEQHKDDYOR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14826224

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.95

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.097

Distribution Coefficient, logD

4.097

Water Solubility, LogSw

-4.30

Polar Surface Area

68.779

Acid Dissociation Constant (pKa)

10.90

Base Dissociation Constant (pKb)

-0.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

D395-0133 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D395-0133 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D395-0133?
Check Price and Availability of D395-0133, 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 D395-0133 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D395-0133
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D395-0133
  • 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 D395-0133 available by request