0086-0058 Screening compound: 2-(2,4-dichlorophenyl)-1,3-dimethyl-2,3-dihydro-1H-1,3-benzodiazole

0086-0058 Screening compound: 2-(2,4-dichlorophenyl)-1,3-dimethyl-2,3-dihydro-1H-1,3-benzodiazole
0086-0058 Screening compound: 2-(2,4-dichlorophenyl)-1,3-dimethyl-2,3-dihydro-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 0086-0058
2-(2,4-dichlorophenyl)-1,3-dimethyl-2,3-dihydro-1H-1,3-benzodiazole

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

0086-0058

Molecular Formula

C15H14Cl2N2 (C15 H14 Cl2 N2)

Compound Name

2-(2,4-dichlorophenyl)-1,3-dimethyl-2,3-dihydro-1H-1,3-benzodiazole

IUPAC name

2-(24-dichlorophenyl)-13-dimethyl-23-dihydro-1H-13-benzodiazole

SMILES

CN1c(cccc2)c2N(C)C1c(ccc(Cl)c1)c1Cl

InChI

InChI=1S/C15H14Cl2N2/c1-18-13-5-3-4-6-14(13)19(2)15(18)11-8-7-10(16)9-12(11)17/h3-9,15H,1-2H3

InChI Key

NFLPTNAGQWPKFX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00186907

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

293.2

Hydrogen Bond Acceptors Count

0.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.393

Distribution Coefficient, logD

4.393

Water Solubility, LogSw

-4.50

Polar Surface Area

4.393

Acid Dissociation Constant (pKa)

28.44

Base Dissociation Constant (pKb)

-0.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

0086-0058 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Fragments Library (11262 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
  • Agro
Structure:
  • Fragments
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 0086-0058 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0086-0058?
Check Price and Availability of 0086-0058, 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 0086-0058 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0086-0058
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0086-0058
  • 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 0086-0058 available by request