8020-5354 Screening compound: ethyl 4-(6-oxo-2,6-dihydronaphtho[1,2,3-cd]indol-1-yl)tetrahydro-1(2H)-pyrazinecarboxylate

8020-5354 Screening compound: ethyl 4-(6-oxo-2,6-dihydronaphtho[1,2,3-cd]indol-1-yl)tetrahydro-1(2H)-pyrazinecarboxylate
8020-5354 Screening compound: ethyl 4-(6-oxo-2,6-dihydronaphtho[1,2,3-cd]indol-1-yl)tetrahydro-1(2H)-pyrazinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-5354
ethyl 4-(6-oxo-2,6-dihydronaphtho[1,2,3-cd]indol-1-yl)tetrahydro-1(2H)-pyrazinecarboxylate

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

8020-5354

Molecular Formula

C22H21N3O3 (C22 H21 N3 O3)

Compound Name

ethyl 4-(6-oxo-2,6-dihydronaphtho[1,2,3-cd]indol-1-yl)tetrahydro-1(2H)-pyrazinecarboxylate

IUPAC name

n/a

SMILES

CCOC(N(CC1)CCN1c([nH]c1cccc2c11)c1-c(cccc1)c1C2=O)=O

InChI

InChI=1S/C22H21N3O3/c1-2-28-22(27)25-12-10-24(11-13-25)21-19-14-6-3-4-7-15(14)20(26)16-8-5-9-17(23-21)18(16)19/h3-9,23H,2,10-13H2,1H3

InChI Key

NHJDGPGCNZPLNJ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.133

Distribution Coefficient, logD

4.133

Water Solubility, LogSw

-4.54

Polar Surface Area

48.549

Acid Dissociation Constant (pKa)

18.81

Base Dissociation Constant (pKb)

4.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with 8020-5354 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-5354?
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What is the minimum amount of 8020-5354 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-5354
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-5354
  • 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 8020-5354 available by request