0651-0051 Screening compound: 4-[(E)-(2-{8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazin-1-ylidene)methyl]-N,N-dimethylaniline

0651-0051 Screening compound: 4-[(E)-(2-{8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazin-1-ylidene)methyl]-N,N-dimethylaniline
0651-0051 Screening compound: 4-[(E)-(2-{8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazin-1-ylidene)methyl]-N,N-dimethylaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound 0651-0051
4-[(E)-(2-{8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazin-1-ylidene)methyl]-N,N-dimethylaniline

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

0651-0051

Molecular Formula

C18H16BrN7 (C18 H16 BrN7)

Compound Name

4-[(E)-(2-{8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazin-1-ylidene)methyl]-N,N-dimethylaniline

IUPAC name

4-[(E)-(2-{8-bromo-5H-[124]triazino[56-b]indol-3-yl}hydrazin-1-ylidene)methyl]-NN-dimethylaniline

SMILES

CN(C)c1ccc(/C=N/Nc2nnc(c(cc(cc3)Br)c3[nH]3)c3n2)cc1

InChI

InChI=1S/C18H16BrN7/c1-26(2)13-6-3-11(4-7-13)10-20-24-18-22-17-16(23-25-18)14-9-12(19)5-8-15(14)21-17/h3-10H,1-2H3,(H2,21,22,24,25)

InChI Key

ZASFKJIVKUNGJA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00636544

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.28

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.782

Distribution Coefficient, logD

3.781

Water Solubility, LogSw

-4.18

Polar Surface Area

68.160

Acid Dissociation Constant (pKa)

14.16

Base Dissociation Constant (pKb)

4.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with 0651-0051 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0651-0051?
Check Price and Availability of 0651-0051, 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 0651-0051 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0651-0051
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0651-0051
  • 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 0651-0051 available by request