L892-0013 Screening compound: 2-(3-chlorophenoxy)-N-[2-methyl-4-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)phenyl]propanamide

L892-0013 Screening compound: 2-(3-chlorophenoxy)-N-[2-methyl-4-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)phenyl]propanamide
L892-0013 Screening compound: 2-(3-chlorophenoxy)-N-[2-methyl-4-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)phenyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L892-0013
2-(3-chlorophenoxy)-N-[2-methyl-4-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)phenyl]propanamide

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

L892-0013

Molecular Formula

C25H22ClN3O3 (C25 H22 ClN3 O3)

Compound Name

2-(3-chlorophenoxy)-N-[2-methyl-4-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)phenyl]propanamide

IUPAC name

2-(3-chlorophenoxy)-N-[2-methyl-4-(2-methyl-4-oxo-34-dihydroquinazolin-3-yl)phenyl]propanamide

SMILES

CC(C(Nc(cc1)c(C)cc1N(C(C)=Nc1c2cccc1)C2=O)=O)Oc1cccc(Cl)c1

InChI

InChI=1S/C25H22ClN3O3/c1-15-13-19(29-17(3)27-23-10-5-4-9-21(23)25(29)31)11-12-22(15)28-24(30)16(2)32-20-8-6-7-18(26)14-20/h4-14,16H,1-3H3,(H,28,30)/t16-/m0/s1

InChI Key

ZFTGGQNHOSPZFN-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27484448

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.92

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.364

Distribution Coefficient, logD

4.215

Water Solubility, LogSw

-4.45

Polar Surface Area

52.956

Acid Dissociation Constant (pKa)

11.93

Base Dissociation Constant (pKb)

7.01

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.00

L892-0013 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with L892-0013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L892-0013?
Check Price and Availability of L892-0013, 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 L892-0013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L892-0013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L892-0013
  • 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 L892-0013 available by request