D534-0895 Screening compound: ethyl 4-{4-[(6-methyl-3-oxo-2,3-dihydropyridazin-4-yl)methyl]benzenesulfonyl}piperazine-1-carboxylate

D534-0895 Screening compound: ethyl 4-{4-[(6-methyl-3-oxo-2,3-dihydropyridazin-4-yl)methyl]benzenesulfonyl}piperazine-1-carboxylate
D534-0895 Screening compound: ethyl 4-{4-[(6-methyl-3-oxo-2,3-dihydropyridazin-4-yl)methyl]benzenesulfonyl}piperazine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D534-0895
ethyl 4-{4-[(6-methyl-3-oxo-2,3-dihydropyridazin-4-yl)methyl]benzenesulfonyl}piperazine-1-carboxylate

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

D534-0895

Molecular Formula

C19H24N4O5S (C19 H24 N4 O5 S)

Compound Name

ethyl 4-{4-[(6-methyl-3-oxo-2,3-dihydropyridazin-4-yl)methyl]benzenesulfonyl}piperazine-1-carboxylate

IUPAC name

ethyl 4-{4-[(6-methyl-3-oxo-23-dihydropyridazin-4-yl)methyl]benzenesulfonyl}piperazine-1-carboxylate

SMILES

CCOC(N(CC1)CCN1S(c1ccc(CC2=CC(C)=NNC2=O)cc1)(=O)=O)=O

InChI

InChI=1S/C19H24N4O5S/c1-3-28-19(25)22-8-10-23(11-9-22)29(26,27)17-6-4-15(5-7-17)13-16-12-14(2)20-21-18(16)24/h4-7,12H,3,8-11,13H2,1-2H3,(H,21,24)

InChI Key

HDDBWMPEFLNEAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14833437

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.49

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.902

Distribution Coefficient, logD

1.902

Water Solubility, LogSw

-2.66

Polar Surface Area

91.097

Acid Dissociation Constant (pKa)

11.91

Base Dissociation Constant (pKb)

-0.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

References: we are preparing a list of scientific research reports with D534-0895 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D534-0895?
Check Price and Availability of D534-0895, 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 D534-0895 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D534-0895
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D534-0895
  • 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 D534-0895 available by request