L857-0227 Screening compound: N-[(4-chlorophenyl)methyl]-4-(morpholin-4-yl)phthalazin-1-amine

L857-0227 Screening compound: N-[(4-chlorophenyl)methyl]-4-(morpholin-4-yl)phthalazin-1-amine
L857-0227 Screening compound: N-[(4-chlorophenyl)methyl]-4-(morpholin-4-yl)phthalazin-1-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound L857-0227
N-[(4-chlorophenyl)methyl]-4-(morpholin-4-yl)phthalazin-1-amine

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

L857-0227

Molecular Formula

C19H19ClN4O (C19 H19 ClN4 O)

Compound Name

N-[(4-chlorophenyl)methyl]-4-(morpholin-4-yl)phthalazin-1-amine

IUPAC name

N-[(4-chlorophenyl)methyl]-4-(morpholin-4-yl)phthalazin-1-amine

SMILES

Clc1ccc(CNc(c2ccccc22)nnc2N2CCOCC2)cc1

InChI

InChI=1S/C19H19ClN4O/c20-15-7-5-14(6-8-15)13-21-18-16-3-1-2-4-17(16)19(23-22-18)24-9-11-25-12-10-24/h1-8H,9-13H2,(H,21,22)

InChI Key

ARDKESKPYWASFQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27480865

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.84

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.615

Distribution Coefficient, logD

3.615

Water Solubility, LogSw

-3.86

Polar Surface Area

43.878

Acid Dissociation Constant (pKa)

18.76

Base Dissociation Constant (pKb)

3.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

L857-0227 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

PI3K-Targeted Library (17255 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L857-0227 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L857-0227?
Check Price and Availability of L857-0227, 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 L857-0227 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L857-0227
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L857-0227
  • 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 L857-0227 available by request