D327-0092 Screening compound: N-(3,4-DIFLUOROPHENYL)-2-[3-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL]PROPANAMIDE

D327-0092 Screening compound: N-(3,4-DIFLUOROPHENYL)-2-[3-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL]PROPANAMIDE
D327-0092 Screening compound: N-(3,4-DIFLUOROPHENYL)-2-[3-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL]PROPANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound D327-0092
N-(3,4-DIFLUOROPHENYL)-2-[3-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL]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

D327-0092

Molecular Formula

C21H17F2N3O4 (C21 H17 F2 N3 O4)

Compound Name

N-(3,4-DIFLUOROPHENYL)-2-[3-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL]PROPANAMIDE

IUPAC name

n/a

SMILES

CC(C(Nc(cc1)cc(F)c1F)=O)N(C(C=C1)=O)N=C1c(cc1)cc2c1OCCO2

InChI

InChI=1S/C21H17F2N3O4/c1-12(21(28)24-14-3-4-15(22)16(23)11-14)26-20(27)7-5-17(25-26)13-2-6-18-19(10-13)30-9-8-29-18/h2-7,10-12H,8-9H2,1H3,(H,24,28)/t12-/m0/s1

InChI Key

KKUGZDWEUNWZDY-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD27580166

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.662

Distribution Coefficient, logD

2.655

Water Solubility, LogSw

-3.14

Polar Surface Area

66.267

Acid Dissociation Constant (pKa)

9.25

Base Dissociation Constant (pKb)

-1.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

D327-0092 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
  • Cancer

References: we are preparing a list of scientific research reports with D327-0092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D327-0092?
Check Price and Availability of D327-0092, 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 D327-0092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D327-0092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D327-0092
  • 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 D327-0092 available by request