C880-0659 Screening compound: 2-{5-benzyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-3-yl}-N-(2-ethylphenyl)acetamide

C880-0659 Screening compound: 2-{5-benzyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-3-yl}-N-(2-ethylphenyl)acetamide
C880-0659 Screening compound: 2-{5-benzyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-3-yl}-N-(2-ethylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C880-0659
2-{5-benzyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-3-yl}-N-(2-ethylphenyl)acetamide

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

C880-0659

Molecular Formula

C27H24N4O2 (C27 H24 N4 O2)

Compound Name

2-{5-benzyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-3-yl}-N-(2-ethylphenyl)acetamide

IUPAC name

2-{5-benzyl-4-oxo-3H4H5H-pyridazino[45-b]indol-3-yl}-N-(2-ethylphenyl)acetamide

SMILES

CCc(cccc1)c1NC(CN(C1=O)N=Cc2c1n(Cc1ccccc1)c1c2cccc1)=O

InChI

InChI=1S/C27H24N4O2/c1-2-20-12-6-8-14-23(20)29-25(32)18-31-27(33)26-22(16-28-31)21-13-7-9-15-24(21)30(26)17-19-10-4-3-5-11-19/h3-16H,2,17-18H2,1H3,(H,29,32)

InChI Key

RIVKEGGQGSRCCW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14803874

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.771

Distribution Coefficient, logD

4.771

Water Solubility, LogSw

-4.65

Polar Surface Area

51.523

Acid Dissociation Constant (pKa)

13.32

Base Dissociation Constant (pKb)

-0.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.80

References: we are preparing a list of scientific research reports with C880-0659 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C880-0659?
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What is the minimum amount of C880-0659 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C880-0659
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C880-0659
  • 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 C880-0659 available by request