D161-1990 Screening compound: 1-[(4-bromophenyl)methyl]-1H-indazole

D161-1990 Screening compound: 1-[(4-bromophenyl)methyl]-1H-indazole
D161-1990 Screening compound: 1-[(4-bromophenyl)methyl]-1H-indazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D161-1990
1-[(4-bromophenyl)methyl]-1H-indazole

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

D161-1990

Molecular Formula

C14H11BrN2 (C14 H11 BrN2)

Compound Name

1-[(4-bromophenyl)methyl]-1H-indazole

IUPAC name

1-[(4-bromophenyl)methyl]-1H-indazole

SMILES

Brc1ccc(Cn2ncc3c2cccc3)cc1

InChI

InChI=1S/C14H11BrN2/c15-13-7-5-11(6-8-13)10-17-14-4-2-1-3-12(14)9-16-17/h1-9H,10H2

InChI Key

YOMDXWJHWSFEGY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06421559

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

287.16

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.009

Distribution Coefficient, logD

4.009

Water Solubility, LogSw

-4.21

Polar Surface Area

13.670

Acid Dissociation Constant (pKa)

28.58

Base Dissociation Constant (pKb)

-0.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

D161-1990 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Cardiovascular Library (22201 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with D161-1990 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D161-1990?
Check Price and Availability of D161-1990, 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 D161-1990 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D161-1990
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D161-1990
  • 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 D161-1990 available by request