5519-0731 Screening compound: N-[(1H-INDOL-3-YL)METHYL]-1-METHYL-1H-1,3-BENZODIAZOL-2-AMINE

5519-0731 Screening compound: N-[(1H-INDOL-3-YL)METHYL]-1-METHYL-1H-1,3-BENZODIAZOL-2-AMINE
5519-0731 Screening compound: N-[(1H-INDOL-3-YL)METHYL]-1-METHYL-1H-1,3-BENZODIAZOL-2-AMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound 5519-0731
N-[(1H-INDOL-3-YL)METHYL]-1-METHYL-1H-1,3-BENZODIAZOL-2-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

5519-0731

Molecular Formula

C17H16N4 (C17 H16 N4)

Compound Name

N-[(1H-INDOL-3-YL)METHYL]-1-METHYL-1H-1,3-BENZODIAZOL-2-AMINE

IUPAC name

n/a

SMILES

Cn1c(NCc2c[nH]c3c2cccc3)nc2c1cccc2

InChI

InChI=1S/C17H16N4/c1-21-16-9-5-4-8-15(16)20-17(21)19-11-12-10-18-14-7-3-2-6-13(12)14/h2-10,18H,11H2,1H3,(H,19,20)

InChI Key

FOIVXEQNSMOVOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03683267

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

276.34

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.343

Distribution Coefficient, logD

2.739

Water Solubility, LogSw

-3.35

Polar Surface Area

33.261

Acid Dissociation Constant (pKa)

18.51

Base Dissociation Constant (pKb)

7.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

2.00

5519-0731 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CNS targets activity set (6557 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 5519-0731 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5519-0731?
Check Price and Availability of 5519-0731, 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 5519-0731 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5519-0731
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5519-0731
  • 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 5519-0731 available by request