L085-0001 Screening compound: 1-(3-bromophenoxy)-4-methylphthalazine

L085-0001 Screening compound: 1-(3-bromophenoxy)-4-methylphthalazine
L085-0001 Screening compound: 1-(3-bromophenoxy)-4-methylphthalazine alternative view

Chemical Structure Depiction of ChemDiv screening compound L085-0001
1-(3-bromophenoxy)-4-methylphthalazine

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

L085-0001

Molecular Formula

C15H11BrN2O (C15 H11 BrN2 O)

Compound Name

1-(3-bromophenoxy)-4-methylphthalazine

IUPAC name

1-(3-bromophenoxy)-4-methylphthalazine

SMILES

Cc(c1ccccc11)nnc1Oc1cccc(Br)c1

InChI

InChI=1S/C15H11BrN2O/c1-10-13-7-2-3-8-14(13)15(18-17-10)19-12-6-4-5-11(16)9-12/h2-9H,1H3

InChI Key

JWZSLSPPXWPAJB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12476245

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.17

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.181

Distribution Coefficient, logD

4.181

Water Solubility, LogSw

-4.53

Polar Surface Area

29.792

Acid Dissociation Constant (pKa)

26.00

Base Dissociation Constant (pKb)

3.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

L085-0001 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with L085-0001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L085-0001?
Check Price and Availability of L085-0001, 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 L085-0001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L085-0001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L085-0001
  • 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 L085-0001 available by request