C884-1440 Screening compound: ethyl 1-(2-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}butanoyl)piperidine-4-carboxylate

C884-1440 Screening compound: ethyl 1-(2-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}butanoyl)piperidine-4-carboxylate
C884-1440 Screening compound: ethyl 1-(2-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}butanoyl)piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C884-1440
ethyl 1-(2-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}butanoyl)piperidine-4-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

C884-1440

Molecular Formula

C23H28N4O4 (C23 H28 N4 O4)

Compound Name

ethyl 1-(2-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}butanoyl)piperidine-4-carboxylate

IUPAC name

ethyl 1-(2-{3-methyl-4-oxo-3H4H5H-pyridazino[45-b]indol-5-yl}butanoyl)piperidine-4-carboxylate

SMILES

CCC(C(N(CC1)CCC1C(OCC)=O)=O)n1c(C(N(C)N=C2)=O)c2c2c1cccc2

InChI

InChI=1S/C23H28N4O4/c1-4-18(21(28)26-12-10-15(11-13-26)23(30)31-5-2)27-19-9-7-6-8-16(19)17-14-24-25(3)22(29)20(17)27/h6-9,14-15,18H,4-5,10-13H2,1-3H3/t18-/m0/s1

InChI Key

GWLUICUPPYKGQG-SFHVURJKSA-N

MDL Number (MFCD)

MFCD26966793

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.321

Distribution Coefficient, logD

2.321

Water Solubility, LogSw

-2.34

Polar Surface Area

66.976

Acid Dissociation Constant (pKa)

19.55

Base Dissociation Constant (pKb)

3.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.80

References: we are preparing a list of scientific research reports with C884-1440 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C884-1440?
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What is the minimum amount of C884-1440 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C884-1440
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C884-1440
  • 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 C884-1440 available by request