Y043-8147 Screening compound: 2,5-dioxo-1-pyrrolidinyl 2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetate

Y043-8147 Screening compound: 2,5-dioxo-1-pyrrolidinyl 2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetate
Y043-8147 Screening compound: 2,5-dioxo-1-pyrrolidinyl 2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-8147
2,5-dioxo-1-pyrrolidinyl 2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetate

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

Y043-8147

Molecular Formula

C15H17N3O5 (C15 H17 N3 O5)

Compound Name

2,5-dioxo-1-pyrrolidinyl 2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetate

IUPAC name

25-dioxopyrrolidin-1-yl 2-{3-oxo-2H3H5H6H7H8H9H-cyclohepta[c]pyridazin-2-yl}acetate

SMILES

O=C(CN1N=C(CCCCC2)C2=CC1=O)ON(C(CC1)=O)C1=O

InChI

InChI=1S/C15H17N3O5/c19-12-6-7-13(20)18(12)23-15(22)9-17-14(21)8-10-4-2-1-3-5-11(10)16-17/h8H,1-7,9H2

InChI Key

BHAHVCPRSYQJRE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31704276

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.32

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-0.713

Distribution Coefficient, logD

-0.713

Water Solubility, LogSw

-0.16

Polar Surface Area

81.222

Acid Dissociation Constant (pKa)

18.23

Base Dissociation Constant (pKb)

-0.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.33

References: we are preparing a list of scientific research reports with Y043-8147 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-8147?
Check Price and Availability of Y043-8147, 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 Y043-8147 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-8147
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-8147
  • 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 Y043-8147 available by request