D223-0978 Screening compound: 1-(4-fluorophenyl)-N-{3-[(2-methoxyethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-4-oxo-1,4-dihydropyridazine-3-carboxamide

D223-0978 Screening compound: 1-(4-fluorophenyl)-N-{3-[(2-methoxyethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-4-oxo-1,4-dihydropyridazine-3-carboxamide
D223-0978 Screening compound: 1-(4-fluorophenyl)-N-{3-[(2-methoxyethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-4-oxo-1,4-dihydropyridazine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D223-0978
1-(4-fluorophenyl)-N-{3-[(2-methoxyethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-4-oxo-1,4-dihydropyridazine-3-carboxamide

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

D223-0978

Molecular Formula

C23H23FN4O4S (C23 H23 FN4 O4 S)

Compound Name

1-(4-fluorophenyl)-N-{3-[(2-methoxyethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-4-oxo-1,4-dihydropyridazine-3-carboxamide

IUPAC name

1-(4-fluorophenyl)-N-{3-[(2-methoxyethyl)carbamoyl]-4567-tetrahydro-1-benzothiophen-2-yl}-4-oxo-14-dihydropyridazine-3-carboxamide

SMILES

COCCNC(c1c(NC(C(C(C=C2)=O)=NN2c(cc2)ccc2F)=O)sc2c1CCCC2)=O

InChI

InChI=1S/C23H23FN4O4S/c1-32-13-11-25-21(30)19-16-4-2-3-5-18(16)33-23(19)26-22(31)20-17(29)10-12-28(27-20)15-8-6-14(24)7-9-15/h6-10,12H,2-5,11,13H2,1H3,(H,25,30)(H,26,31)

InChI Key

OSYBUWJZVMRZRC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08288903

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.942

Distribution Coefficient, logD

-1.038

Water Solubility, LogSw

-3.58

Polar Surface Area

82.324

Acid Dissociation Constant (pKa)

3.42

Base Dissociation Constant (pKb)

-1.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with D223-0978 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D223-0978?
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What is the minimum amount of D223-0978 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D223-0978
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D223-0978
  • 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 D223-0978 available by request