C700-1099 Screening compound: ethyl 1-(2-{7-oxo-6H,7H-thieno[2,3-d]pyridazin-6-yl}acetyl)piperidine-3-carboxylate

C700-1099 Screening compound: ethyl 1-(2-{7-oxo-6H,7H-thieno[2,3-d]pyridazin-6-yl}acetyl)piperidine-3-carboxylate
C700-1099 Screening compound: ethyl 1-(2-{7-oxo-6H,7H-thieno[2,3-d]pyridazin-6-yl}acetyl)piperidine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C700-1099
ethyl 1-(2-{7-oxo-6H,7H-thieno[2,3-d]pyridazin-6-yl}acetyl)piperidine-3-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

C700-1099

Molecular Formula

C16H19N3O4S (C16 H19 N3 O4 S)

Compound Name

ethyl 1-(2-{7-oxo-6H,7H-thieno[2,3-d]pyridazin-6-yl}acetyl)piperidine-3-carboxylate

IUPAC name

ethyl 1-(2-{7-oxo-6H7H-thieno[23-d]pyridazin-6-yl}acetyl)piperidine-3-carboxylate

SMILES

CCOC(C(CCC1)CN1C(CN(C1=O)N=Cc2c1scc2)=O)=O

InChI

InChI=1S/C16H19N3O4S/c1-2-23-16(22)12-4-3-6-18(9-12)13(20)10-19-15(21)14-11(8-17-19)5-7-24-14/h5,7-8,12H,2-4,6,9-10H2,1H3/t12-/m0/s1

InChI Key

MPYPVPKYVJVQIB-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD14785266

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.941

Distribution Coefficient, logD

0.941

Water Solubility, LogSw

-2.20

Polar Surface Area

66.328

Acid Dissociation Constant (pKa)

18.87

Base Dissociation Constant (pKb)

-0.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with C700-1099 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C700-1099?
Check Price and Availability of C700-1099, 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 C700-1099 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C700-1099
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C700-1099
  • 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 C700-1099 available by request