8017-0955 Screening compound: N-[2-(2-methyl-1H-indol-3-yl)ethyl]-N-(5-nitro-2-pyridyl)amine

8017-0955 Screening compound: N-[2-(2-methyl-1H-indol-3-yl)ethyl]-N-(5-nitro-2-pyridyl)amine
8017-0955 Screening compound: N-[2-(2-methyl-1H-indol-3-yl)ethyl]-N-(5-nitro-2-pyridyl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-0955
N-[2-(2-methyl-1H-indol-3-yl)ethyl]-N-(5-nitro-2-pyridyl)amine

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

8017-0955

Molecular Formula

C16H16N4O2 (C16 H16 N4 O2)

Compound Name

N-[2-(2-methyl-1H-indol-3-yl)ethyl]-N-(5-nitro-2-pyridyl)amine

IUPAC name

N-[2-(2-methyl-1H-indol-3-yl)ethyl]-5-nitropyridin-2-amine

SMILES

Cc1c(CCNc(cc2)ncc2[N+]([O-])=O)c(cccc2)c2[nH]1

InChI

InChI=1S/C16H16N4O2/c1-11-13(14-4-2-3-5-15(14)19-11)8-9-17-16-7-6-12(10-18-16)20(21)22/h2-7,10,19H,8-9H2,1H3,(H,17,18)

InChI Key

ISMJLTRZXMZNJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06014021

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.412

Distribution Coefficient, logD

3.412

Water Solubility, LogSw

-3.58

Polar Surface Area

63.327

Acid Dissociation Constant (pKa)

16.43

Base Dissociation Constant (pKb)

1.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.75

References: we are preparing a list of scientific research reports with 8017-0955 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-0955?
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What is the minimum amount of 8017-0955 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-0955
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-0955
  • 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 8017-0955 available by request