3224-0008 Screening compound: 2-(4-bromophenyl)-7-chloro-5-phenyl-3H-1,3,4-benzotriazepine

3224-0008 Screening compound: 2-(4-bromophenyl)-7-chloro-5-phenyl-3H-1,3,4-benzotriazepine
3224-0008 Screening compound: 2-(4-bromophenyl)-7-chloro-5-phenyl-3H-1,3,4-benzotriazepine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3224-0008
2-(4-bromophenyl)-7-chloro-5-phenyl-3H-1,3,4-benzotriazepine

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

3224-0008

Molecular Formula

C20H13BrClN3 (C20 H13 BrClN3)

Compound Name

2-(4-bromophenyl)-7-chloro-5-phenyl-3H-1,3,4-benzotriazepine

IUPAC name

2-(4-bromophenyl)-7-chloro-5-phenyl-3H-134-benzotriazepine

SMILES

Clc(cc1)cc2c1N=C(c(cc1)ccc1Br)NN=C2c1ccccc1

InChI

InChI=1S/C20H13BrClN3/c21-15-8-6-14(7-9-15)20-23-18-11-10-16(22)12-17(18)19(24-25-20)13-4-2-1-3-5-13/h1-12H,(H,23,25)

InChI Key

UFORYSBQJBAPHO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02585949

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.7

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.895

Distribution Coefficient, logD

5.707

Water Solubility, LogSw

-6.34

Polar Surface Area

32.942

Acid Dissociation Constant (pKa)

11.91

Base Dissociation Constant (pKb)

7.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

3224-0008 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiparasite Library (23996 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Immune system
  • animal
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
  • Others
  • Kinases
Agro:
  • Agro
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3224-0008 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3224-0008?
Check Price and Availability of 3224-0008, 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 3224-0008 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3224-0008
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3224-0008
  • 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 3224-0008 available by request